Elexacaftor CAS#: 2216712-66-0

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

Identification

英文名 Elexacaftor
分子结构
CAS编号 2216712-66-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 S)-N-((1,3-Dimethyl-1H-pyrazol-4-yl)sulfonyl)-6-(3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl)-2-(2,2,4-trimethylpyrrolidin-1-yl)nicotinamide
分子式 C26H34F3N7O4S
分子量 597.7
InChI
InChI Key
Canonical SMILES O=C(C1=C(N(C(C)(C2)C)C[C@H]2C)N=C(N(C=C3)N=C3OCC(C)(C)C(F)(F)F)C=C1)N[S](=O)(C(C(C)=N4)=CN4C)=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
Elexacaftor is chemically S)-N-((1,3-Dimethyl-1H-pyrazol-4-yl)sulfonyl)-6-(3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl)-2-(2,2,4-trimethylpyrrolidin-1-yl)nicotinamide. Elexacaftor is supplied with detailed characterization data compliant with regulatory guideline. Elexacaftor 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 Elexacaftor. 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.

Elexacaftor Impurity 2 CAS#: 1013647-75-0

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

Identification

英文名 Elexacaftor Impurity 2
分子结构
CAS编号 1013647-75-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 Tert-butyl 2,6-dichloronicotinate
分子式 C10H11Cl2NO2
分子量 248.1
InChI
InChI Key
Canonical SMILES O=C(C(C=CC(Cl)=N1)=C1Cl)OC(C)(C)C

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
Elexacaftor Impurity 2 is chemically Tert-butyl 2,6-dichloronicotinate. Elexacaftor Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. Elexacaftor 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 Elexacaftor. 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.

Elexacaftor Impurity 3 CAS#: 2229861-18-9

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

Identification

英文名 Elexacaftor Impurity 3
分子结构
CAS编号 2229861-18-9
EINECS Number
MDL Number
Beilstein Registry Number
别名 2-chloro-N-((1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-6-(3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl)nicotinamide
分子式 C19H20ClF3N6O4S
分子量 520.9
InChI
InChI Key
Canonical SMILES CC(C(F)(F)F)(C)COC1=NN(C(N=C2Cl)=CC=C2C(N[S](=O)(C(C(C)=N3)=CN3C)=O)=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
Elexacaftor Impurity 3 is chemically 2-chloro-N-((1,3-dimethyl-1H-pyrazol-4-yl)sulfonyl)-6-(3-(3,3,3-trifluoro-2,2-dimethylpropoxy)-1H-pyrazol-1-yl)nicotinamide. Elexacaftor Impurity 3 is supplied with detailed characterization data compliant with regulatory guideline. Elexacaftor Impurity 3 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 Elexacaftor. 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.

Elexacaftor Impurity 1 CAS#: 2229861-15-6

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

Identification

英文名 Elexacaftor Impurity 1
分子结构
CAS编号 2229861-15-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-(3,3,3-Trifluoro-2,2-dimethylpropoxy)-1H-pyrazole
分子式 C8H11F3N2O
分子量 208.2
InChI
InChI Key
Canonical SMILES CC(C(F)(F)F)(C)COC1=NNC=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
Elexacaftor Impurity 1 is chemically 3-(3,3,3-Trifluoro-2,2-dimethylpropoxy)-1H-pyrazole. Elexacaftor Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Elexacaftor 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 Elexacaftor. 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.