Itraconazole Impurity 29 CAS#: N/A

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

Identification

英文名 Itraconazole Impurity 29
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-(4-(4-((2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(4-chlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)ethan-1-one
分子式 C25H28ClN5O4
分子量 498.0
InChI
InChI Key
Canonical SMILES ClC1=CC=C(C2(CN3C=NC=N3)OC(CO2)COC4=CC=C(C=C4)N5CCN(CC5)C(C)=O)C=C1

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
Itraconazole Impurity 29 is chemically 1-(4-(4-((2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(4-chlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)ethan-1-one. Itraconazole Impurity 29 is supplied with detailed characterization data compliant with regulatory guideline. Itraconazole Impurity 29 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 Itraconazole . 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.

Itraconazole D9 CAS#: 1309272-50-1

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

Identification

英文名 Itraconazole D9
分子结构
CAS编号 1309272-50-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(4-(4-(4-(((2R,4S)-2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(butan-2-yl-d9)-2,4-dihydro-3H-1,2,4-triazol-3-one
分子式 C35H29D9Cl2N8O4
分子量 714.7
InChI
InChI Key
Canonical SMILES ClC1=C(C=CC(Cl)=C1)[C@@]2(O[C@@H](COC3=CC=C(N4CCN(C5=CC=C(N(C=NN6C(C([2H])([2H])[2H])([2H])C([2H])([2H])C([2H])([2H])[2H])C6=O)C=C5)CC4)C=C3)CO2)CN7C=NC=N7

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
Itraconazole D9 is chemically 4-(4-(4-(4-(((2R,4S)-2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(butan-2-yl-d9)-2,4-dihydro-3H-1,2,4-triazol-3-one. Itraconazole D9 is supplied with detailed characterization data compliant with regulatory guideline. Itraconazole D9 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 Itraconazole . 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.

Itraconazole D3 CAS#: 1217512-35-0

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

Identification

英文名 Itraconazole D3
分子结构
CAS编号 1217512-35-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(4-(4-(4-(((2R,4S)-2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(butan-2-yl-1,1,1-d3)-2,4-dihydro-3H-1,2,4-triazol-3-one
分子式 C35H35D3Cl2N8O4
分子量 708.7
InChI
InChI Key
Canonical SMILES ClC1=C(C=CC(Cl)=C1)[C@@]2(O[C@@H](COC3=CC=C(N4CCN(C5=CC=C(N(C=NN6C(C([2H])([2H])[2H])CC)C6=O)C=C5)CC4)C=C3)CO2)CN7C=NC=N7

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
Itraconazole D3 is chemically 4-(4-(4-(4-(((2R,4S)-2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(butan-2-yl-1,1,1-d3)-2,4-dihydro-3H-1,2,4-triazol-3-one. Itraconazole D3 is supplied with detailed characterization data compliant with regulatory guideline. Itraconazole D3 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 Itraconazole . 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.

N-Nitroso Itraconazole Impurity 1 CAS#: 75051-59-1

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

Identification

英文名 N-Nitroso Itraconazole Impurity 1
分子结构
CAS编号 75051-59-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-(4-Methoxyphenyl)-4-nitrosopiperazine
分子式 C11H15N3O2
分子量 221.3
InChI
InChI Key
Canonical SMILES O=NN1CCN(C2=CC=C(OC)C=C2)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
Use Pattern
N-Nitroso Itraconazole Impurity 1 is chemically 1-(4-Methoxyphenyl)-4-nitrosopiperazine. N-Nitroso Itraconazole Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Itraconazole Impurity 1 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 Itraconazole . 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.

Itraconazole 4-Triazolyl Isomer CAS#: 1427177-65-8

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

Identification

英文名 Itraconazole 4-Triazolyl Isomer
分子结构
CAS编号 1427177-65-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(4-(4-(4-((2-((4H-1,2,4-Triazol-4-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(sec-butyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
分子式 C35H38Cl2N8O4
分子量 705.6
InChI
InChI Key
Canonical SMILES ClC1=C(C=CC(Cl)=C1)C2(OC(COC3=CC=C(N4CCN(C5=CC=C(N(C=NN6C(C)CC)C6=O)C=C5)CC4)C=C3)CO2)CN7C=NN=C7

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
Itraconazole 4-Triazolyl Isomer is chemically 4-(4-(4-(4-((2-((4H-1,2,4-Triazol-4-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-(sec-butyl)-2,4-dihydro-3H-1,2,4-triazol-3-one. Itraconazole 4-Triazolyl Isomer is supplied with detailed characterization data compliant with regulatory guideline. Itraconazole 4-Triazolyl Isomer 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 Itraconazole . 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.

N-Nitroso Itraconazole Impurity 2 CAS#: N/A

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

Identification

英文名 N-Nitroso Itraconazole Impurity 2
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-(3-Methoxyphenyl)-4-nitrosopiperazine
分子式 C11H15N3O2
分子量 221.3
InChI
InChI Key
Canonical SMILES O=NN1CCN(C2=CC=CC(OC)=C2)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
Use Pattern
N-Nitroso Itraconazole Impurity 2 is chemically 1-(3-Methoxyphenyl)-4-nitrosopiperazine. N-Nitroso Itraconazole Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Itraconazole Impurity 2 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 Itraconazole . 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.

Itraconazole EP Impurity C + D CAS#: N/A

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

Identification

英文名 Itraconazole EP Impurity C + D
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(4-(4-(4-(((2S,4R)-2-((1H-1,2,4-triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-isopropyl-2,4-dihydro-3H-1,2,4-triazol-3-one compound with 4-(4-(4-(4-(((2S,4R)-2-((1H-1,2,4-triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-propyl-2,4-dihydro-3H-1,2,4-triazol-3-one (1:1)
分子式 C34H36Cl2N8O4
分子量 691.6
InChI
InChI Key
Canonical SMILES O=C1N(CCC)N=CN1C2=CC=C(N3CCN(C4=CC=C(OC[C@H]5O[C@](CN6N=CN=C6)(C7=CC=C(Cl)C=C7Cl)OC5)C=C4)CC3)C=C2.O=C8N(C(C)C)N=CN8C9=CC=C(N%10CCN(C%11=CC=C(OC[C@H]%12O[C@](CN%13N=CN=C%13)(C%14=CC=C(Cl)C=C%14Cl)OC%12)C=C%11)CC%10)C=C9

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
Itraconazole EP Impurity C + D is chemically 4-(4-(4-(4-(((2S,4R)-2-((1H-1,2,4-triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-isopropyl-2,4-dihydro-3H-1,2,4-triazol-3-one compound with 4-(4-(4-(4-(((2S,4R)-2-((1H-1,2,4-triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methoxy)phenyl)piperazin-1-yl)phenyl)-2-propyl-2,4-dihydro-3H-1,2,4-triazol-3-one (1:1). Itraconazole EP Impurity C + D is supplied with detailed characterization data compliant with regulatory guideline. Itraconazole EP Impurity C + D 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 Itraconazole . 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.

Cis-Tosylate CAS#: 154003-23-3

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

Identification

英文名 Cis-Tosylate
分子结构
CAS编号 154003-23-3
EINECS Number
MDL Number
Beilstein Registry Number
别名 ((2R,4R)-2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-methylbenzenesulfonate
分子式 C20H19Cl2N3O5S
分子量 484.3
InChI
InChI Key
Canonical SMILES ClC1=C(C=CC(Cl)=C1)[C@](O[C@H]2CO[S](=O)(C(C=C3)=CC=C3C)=O)(OC2)CN4C=NC=N4

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
Cis-Tosylate is chemically ((2R,4R)-2-((1H-1,2,4-Triazol-1-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl 4-methylbenzenesulfonate. Cis-Tosylate is supplied with detailed characterization data compliant with regulatory guideline. Cis-Tosylate 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 Itraconazole . 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.

Itraconazole Impurity 27 CAS#: 56-37-1

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

Identification

英文名 Itraconazole Impurity 27
分子结构
CAS编号 56-37-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-Benzyl-N,N-diethylethanaminium chloride
分子式 C13H22N : Cl
分子量 192.3 : 35.5
InChI
InChI Key
Canonical SMILES CC[N+](CC)(CC1=CC=CC=C1)CC.[Cl-]

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 16652-03-2 (free base)
Use Pattern
Itraconazole Impurity 27 is chemically N-Benzyl-N,N-diethylethanaminium chloride. Itraconazole Impurity 27 is supplied with detailed characterization data compliant with regulatory guideline. Itraconazole Impurity 27 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 Itraconazole . 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.

Itraconazole Impurity 22 CAS#: N/A

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

Identification

英文名 Itraconazole Impurity 22
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 ((2S,4S)-2-((4H-1,2,4-Triazol-4-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl methanesulfonate
分子式 C14H15Cl2N3O5S
分子量 408.3
InChI
InChI Key
Canonical SMILES ClC1=C([C@@]2(CN3C=NN=C3)O[C@H](COS(=O)(C)=O)CO2)C=CC(Cl)=C1

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
Itraconazole Impurity 22 is chemically ((2S,4S)-2-((4H-1,2,4-Triazol-4-yl)methyl)-2-(2,4-dichlorophenyl)-1,3-dioxolan-4-yl)methyl methanesulfonate. Itraconazole Impurity 22 is supplied with detailed characterization data compliant with regulatory guideline. Itraconazole Impurity 22 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 Itraconazole . 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.