Atracurium EP impurity K (2TFA salt) CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium EP impurity K (2TFA salt)
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 2,2′-[Hexane-1,5-diylbis[oxy(3-oxopropane-1,3-diyl)]]bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium] 2,2,2-trifluoroacetate (as per EP)
分子式 C54H74N2O12 : 2(C2F3O2)
分子量 943.2 : 2(113.0)
InChI
InChI Key
Canonical SMILES O=C(OCCCCC(C)OC(CC[N+]1(C)C(CC2=CC=C(OC)C(OC)=C2)C3=C(C=C(OC)C(OC)=C3)CC1)=O)CC[N+]4(C)C(CC5=CC=C(OC)C(OC)=C5)C6=C(C=C(OC)C(OC)=C6)CC4.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 2767988-79-2 (free base) ; 2767988-80-5 (Diiodide salt)
Use Pattern
Atracurium EP impurity K (2TFA salt) is chemically 2,2′-[Hexane-1,5-diylbis[oxy(3-oxopropane-1,3-diyl)]]bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium] 2,2,2-trifluoroacetate (as per EP). Atracurium EP impurity K (2TFA salt) is supplied with detailed characterization data compliant with regulatory guideline. Atracurium EP impurity K (2TFA salt) can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium Impurity A2 (cis-Monoquatenary) CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium Impurity A2 (cis-Monoquatenary)
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1R,2R)-1-(3,4-dimethoxybenzyl)-2-(3-((5-((3-((R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)propanoyl)oxy)pentyl)oxy)-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium
分子式 C52H69N2O12
分子量 914.1
InChI
InChI Key
Canonical SMILES COC1=CC([C@@H](CC(C=C2)=CC(OC)=C2OC)N(CCC(OCCCCCOC(CC[N@+](CC3)(C)[C@H](CC(C=C4)=CC(OC)=C4OC)C(C=C5OC)=C3C=C5OC)=O)=O)CC6)=C6C=C1OC

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Atracurium Impurity A2 (cis-Monoquatenary) is chemically (1R,2R)-1-(3,4-dimethoxybenzyl)-2-(3-((5-((3-((R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl)propanoyl)oxy)pentyl)oxy)-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium . Atracurium Impurity A2 (cis-Monoquatenary) is supplied with detailed characterization data compliant with regulatory guideline. Atracurium Impurity A2 (cis-Monoquatenary) can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium cis-Quaternary methyl ester CAS#: 1075726-87-2

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium cis-Quaternary methyl ester
分子结构
CAS编号 1075726-87-2
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1R,2R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-(3-methoxy-3-oxopropyl)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium
分子式 C25H34NO6
分子量 444.5
InChI
InChI Key
Canonical SMILES C[N@@+]1(CCC(OC)=O)[C@H](CC2=CC=C(OC)C(OC)=C2)C3=C(C=C(OC)C(OC)=C3)CC1

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 1075726-91-8 (Iodide salt) ; 1075726-88-3 (besylate salt)
Use Pattern
Atracurium cis-Quaternary methyl ester is chemically (1R,2R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-(3-methoxy-3-oxopropyl)-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium. It is also known as Cisatracurium EP Impurity D. Atracurium cis-Quaternary methyl ester is supplied with detailed characterization data compliant with regulatory guideline. Atracurium cis-Quaternary methyl ester can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium Impurity C2 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium Impurity C2
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (2R)-2-(3-((5-(acryloyloxy)pentyl)oxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium
分子式 C32H44NO8
分子量 570.7
InChI
InChI Key
Canonical SMILES C[N@@+](CC1)(CCC(OCCCCCOC(C=C)=O)=O)C(CC(C=C2)=CC(OC)=C2OC)C(C=C3OC)=C1C=C3OC

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Atracurium Impurity C2 is chemically (2R)-2-(3-((5-(acryloyloxy)pentyl)oxy)-3-oxopropyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium. Atracurium Impurity C2 is supplied with detailed characterization data compliant with regulatory guideline. Atracurium Impurity C2 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium EP impurity C CAS#: 86293-35-8

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium EP impurity C
分子结构
CAS编号 86293-35-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-(3,4-dimethoxybenzyl)-2-(3,11-dioxo-4,10-dioxatridec-12-enyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium (as per EP & USP)
分子式 C32H44NO8
分子量 570.7
InChI
InChI Key
Canonical SMILES COC1=CC(CC[N+](C)(CCC(OCCCCCOC(C=C)=O)=O)C2CC3=CC=C(OC)C(OC)=C3)=C2C=C1OC

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 2767988-75-8 (iodide salt)
Use Pattern
Atracurium EP impurity C is chemically 1-(3,4-dimethoxybenzyl)-2-(3,11-dioxo-4,10-dioxatridec-12-enyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium (as per EP & USP). Atracurium EP impurity C is supplied with detailed characterization data compliant with regulatory guideline. Atracurium EP impurity C can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium EP Impurity I (2TFA salt) CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium EP Impurity I (2TFA salt)
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 2,2′-[(3-Methylpentane-1,5-diyl)bis[oxy(3-oxopropane-1,3-diyl)]]bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium] 2,2,2-trifluoroacetate (as per EP)
分子式 C54H74N2O12 : 2(C2F3O2)
分子量 943.2 : 2(113.0)
InChI
InChI Key
Canonical SMILES C[N+]1(CCC(OCCC(C)CCOC(CC[N+]2(C)C(CC3=CC=C(OC)C(OC)=C3)C4=C(C=C(OC)C(OC)=C4)CC2)=O)=O)C(CC5=CC=C(OC)C(OC)=C5)C6=C(C=C(OC)C(OC)=C6)CC1.O=C([O-])C(F)(F)F.O=C([O-])C(F)(F)F

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 64229-00-1 (free base) ; 2767988-78-1 (Diiodide salt)
Use Pattern
Atracurium EP Impurity I (2TFA salt) is chemically 2,2′-[(3-Methylpentane-1,5-diyl)bis[oxy(3-oxopropane-1,3-diyl)]]bis[1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium] 2,2,2-trifluoroacetate (as per EP). Atracurium EP Impurity I (2TFA salt) is supplied with detailed characterization data compliant with regulatory guideline. Atracurium EP Impurity I (2TFA salt) can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium Impurity D1 (Besylate salt) CAS#: 2922251-88-3

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium Impurity D1 (Besylate salt)
分子结构
CAS编号 2922251-88-3
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1R,2S)-1-(3,4-Dimethoxybenzyl)-2-(3-((5-hydroxypentyl)oxy)-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate
分子式 C29H42NO7 : C6H5O3S
分子量 516.7 : 157.2
InChI
InChI Key
Canonical SMILES C[N@+](CC1)(CCC(OCCCCCO)=O)[C@H](CC(C=C2)=CC(OC)=C2OC)C(C=C3OC)=C1C=C3OC.O=S(C4=CC=CC=C4)([O-])=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 2922251-87-2 (free base)
Use Pattern
Atracurium Impurity D1 (Besylate salt) is chemically (1R,2S)-1-(3,4-Dimethoxybenzyl)-2-(3-((5-hydroxypentyl)oxy)-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate. Atracurium Impurity D1 (Besylate salt) is supplied with detailed characterization data compliant with regulatory guideline. Atracurium Impurity D1 (Besylate salt) can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium EP Impurity E (Besylate salt) CAS#: 2892260-35-2

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium EP Impurity E (Besylate salt)
分子结构
CAS编号 2892260-35-2
EINECS Number
MDL Number
Beilstein Registry Number
别名 2-(2-Carboxyethyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium benzenesulfonate (as per EP)
分子式 C24H32NO6 : C6H5O3S
分子量 430.5 : 157.2
InChI
InChI Key
Canonical SMILES C[N+]1(CCC(O)=O)C(CC2=CC=C(OC)C(OC)=C2)C3=C(C=C(OC)C(OC)=C3)CC1.O=S(C4=CC=CC=C4)([O-])=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 99469-29-1 (free base)
Use Pattern
Atracurium EP Impurity E (Besylate salt) is chemically 2-(2-Carboxyethyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium benzenesulfonate (as per EP). Atracurium EP Impurity E (Besylate salt) is supplied with detailed characterization data compliant with regulatory guideline. Atracurium EP Impurity E (Besylate salt) can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium Impurity 10 CAS#: 1193104-95-8

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium Impurity 10
分子结构
CAS编号 1193104-95-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1R,2S)-2-(2-carboxyethyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate
分子式 C24H32NO6 : C6H5O3S
分子量 430.5 : 157.2
InChI
InChI Key
Canonical SMILES COC1=C(C=C2C(CC[N@+](CCC(O)=O)(C)[C@@H]2CC3=CC=C(C(OC)=C3)OC)=C1)OC.O=S(C4=CC=CC=C4)([O-])=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 1193104-94-7 (free base)
Use Pattern
Atracurium Impurity 10 is chemically (1R,2S)-2-(2-carboxyethyl)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate. Atracurium Impurity 10 is supplied with detailed characterization data compliant with regulatory guideline. Atracurium Impurity 10 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Atracurium Impurity 6 CAS#: 96946-50-8

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Atracurium Impurity 6
分子结构
CAS编号 96946-50-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1S,2S)-1-(3,4-dimethoxybenzyl)-2-(3-((5-((3-((1R,2R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanoyl)oxy)pentyl)oxy)-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate
分子式 C53H72N2O122 : C6H5O3S
分子量 929.2 : 157.2
InChI
InChI Key
Canonical SMILES O=C(OCCCCCOC(CC[N@@+]1(C)[C@@H](CC2=CC=C(OC)C(OC)=C2)C3=C(C=C(OC)C(OC)=C3)CC1)=O)CC[N@+]4(C)[C@H](CC5=CC=C(OC)C(OC)=C5)C6=C(C=C(OC)C(OC)=C6)CC4.O=S(C7=CC=CC=C7)([O-])=O.O=S(C8=CC=CC=C8)([O-])=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals 96946-49-5 (free base)
Use Pattern
Atracurium Impurity 6 is chemically (1S,2S)-1-(3,4-dimethoxybenzyl)-2-(3-((5-((3-((1R,2R)-1-(3,4-dimethoxybenzyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium-2-yl)propanoyl)oxy)pentyl)oxy)-3-oxopropyl)-6,7-dimethoxy-2-methyl-1,2,3,4-tetrahydroisoquinolin-2-ium benzenesulfonate. Atracurium Impurity 6 is supplied with detailed characterization data compliant with regulatory guideline. Atracurium Impurity 6 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Atracurium. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.