Ponatinib-D8 CAS#: 1562993-37-6

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

Identification

英文名 Ponatinib-D8
分子结构
CAS编号 1562993-37-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl-2,2,3,3,5,5,6,6-d8)methyl)-3-(trifluoromethyl)phenyl)benzamide
分子式 C29H19D8F3N6O
分子量 540.6
InChI
InChI Key
Canonical SMILES CC(C(C#CC1=CN=C2N1N=CC=C2)=C3)=CC=C3C(NC(C=C4)=CC(C(F)(F)F)=C4CN(C([2H])([2H])C5([2H])[2H])C([2H])([2H])C([2H])([2H])N5C)=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
Use Pattern
Ponatinib-D8 is chemically 3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl-2,2,3,3,5,5,6,6-d8)methyl)-3-(trifluoromethyl)phenyl)benzamide. Ponatinib-D8 is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib-D8 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 Ponatinib. 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.

Ponatinib Impurity 6 CAS#: N/A

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

Identification

英文名 Ponatinib Impurity 6
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 Benzyl 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoate
分子式 C23H17N3O2
分子量 367.4
InChI
InChI Key
Canonical SMILES O=C(OCC1=CC=CC=C1)C2=CC=C(C)C(C#CC3=CN=C4C=CC=NN43)=C2

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
Ponatinib Impurity 6 is chemically Benzyl 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoate. Ponatinib Impurity 6 is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib 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 Ponatinib. 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.

Ponatinib Impurity 1 CAS#: 694499-26-8

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

Identification

英文名 Ponatinib Impurity 1
分子结构
CAS编号 694499-26-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-((4-Methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)aniline
分子式 C13H18F3N3
分子量 273.3
InChI
InChI Key
Canonical SMILES NC1=CC=C(CN2CCN(C)CC2)C(C(F)(F)F)=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
Ponatinib Impurity 1 is chemically 4-((4-Methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)aniline. Ponatinib Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib 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 Ponatinib. 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.

Ponatinib Impurity 7 CAS#: N/A

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

Identification

英文名 Ponatinib Impurity 7
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-Benzyl-4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)aniline
分子式 C20H24F3N3
分子量 363.4
InChI
InChI Key
Canonical SMILES FC(C1=CC(NCC2=CC=CC=C2)=CC=C1CN3CCN(C)CC3)(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
Use Pattern
Ponatinib Impurity 7 is chemically N-Benzyl-4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)aniline. Ponatinib Impurity 7 is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib Impurity 7 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 Ponatinib. 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.

Ponatinib N-Oxide CAS#: 2227480-51-3

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

Identification

英文名 Ponatinib N-Oxide
分子结构
CAS编号 2227480-51-3
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(4-(3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamido)-2-(trifluoromethyl)benzyl)-1-methylpiperazine 1-oxide
分子式 C29H27F3N6O2
分子量 548.6
InChI
InChI Key
Canonical SMILES C[N+]1([O-])CCN(CC2=CC=C(NC(C3=CC=C(C)C(C#CC4=CN=C5C=CC=NN54)=C3)=O)C=C2C(F)(F)F)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
Ponatinib N-Oxide is chemically 4-(4-(3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamido)-2-(trifluoromethyl)benzyl)-1-methylpiperazine 1-oxide. Ponatinib N-Oxide is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib N-Oxide 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 Ponatinib. 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.

Ponatinib N-beta-D-Glucuronide CAS#: N/A

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

Identification

英文名 Ponatinib N-beta-D-Glucuronide
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-((2R,3R,4S,5S,6S)-6-Carboxy-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)-4-(4-(3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamido)-2-(trifluoromethyl)benzyl)-1-methylpiperazin-1-ium bromide
分子式 C35H36F3N6O7 : Br
分子量 789.6 : 79.9
InChI
InChI Key
Canonical SMILES C[N+]1([C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O2)CCN(CC3=CC=C(NC(C4=CC=C(C)C(C#CC5=CN=C6C=CC=NN65)=C4)=O)C=C3C(F)(F)F)CC1.[Br-]

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
Ponatinib N-beta-D-Glucuronide is chemically 1-((2R,3R,4S,5S,6S)-6-Carboxy-3,4,5-trihydroxytetrahydro-2H-pyran-2-yl)-4-(4-(3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzamido)-2-(trifluoromethyl)benzyl)-1-methylpiperazin-1-ium bromide. Ponatinib N-beta-D-Glucuronide is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib N-beta-D-Glucuronide 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 Ponatinib. 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.

Ponatinib Impurity 4 CAS#: 1356385-96-0

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

Identification

英文名 Ponatinib Impurity 4
分子结构
CAS编号 1356385-96-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 Methyl 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoate
分子式 C17H13N3O2
分子量 291.3
InChI
InChI Key
Canonical SMILES O=C(OC)C1=CC=C(C)C(C#CC2=CN=C3C=CC=NN32)=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
Ponatinib Impurity 4 is chemically Methyl 3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoate. Ponatinib Impurity 4 is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib Impurity 4 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 Ponatinib. 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.

Ponatinib Impurity 5 CAS#: N/A

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

Identification

英文名 Ponatinib Impurity 5
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 3,5-Bis(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide
分子式 C37H30F3N9O
分子量 673.7
InChI
InChI Key
Canonical SMILES O=C(NC1=CC=C(CN2CCN(C)CC2)C(C(F)(F)F)=C1)C3=CC(C#CC4=CN=C5C=CC=NN54)=C(C)C(C#CC6=CN=C7C=CC=NN76)=C3

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
Ponatinib Impurity 5 is chemically 3,5-Bis(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide. Ponatinib Impurity 5 is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib Impurity 5 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 Ponatinib. 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.

Ponatinib Impurity 2 CAS#: 1300690-48-5

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

Identification

英文名 Ponatinib Impurity 2
分子结构
CAS编号 1300690-48-5
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic acid
分子式 C16H11N3O2
分子量 277.3
InChI
InChI Key
Canonical SMILES O=C(O)C1=CC=C(C)C(C#CC2=CN=C3C=CC=NN32)=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 2306904-72-1 (HCl salt)
Use Pattern
Ponatinib Impurity 2 is chemically 3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methylbenzoic acid. Ponatinib Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib 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 Ponatinib. 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.

Ponatinib CAS#: 943319-70-8

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

Identification

英文名 Ponatinib
分子结构
CAS编号 943319-70-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide
分子式 C29H27F3N6O
分子量 532.6
InChI
InChI Key
Canonical SMILES CC1=CC=C(C(NC2=CC(C(F)(F)F)=C(CN3CCN(C)CC3)C=C2)=O)C=C1C#CC4=CN=C5N4N=CC=C5

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 1114544-31-8 (HCl salt)
Use Pattern
Ponatinib is chemically 3-(Imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N-(4-((4-methylpiperazin-1-yl)methyl)-3-(trifluoromethyl)phenyl)benzamide. Ponatinib is supplied with detailed characterization data compliant with regulatory guideline. Ponatinib 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 Ponatinib. 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.