N-Nitroso Tofacitinib 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 N-Nitroso Tofacitinib Impurity 5
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-((3R,4R)-1-Benzyl-4-methylpiperidin-3-yl)-N-methylnitrous amide
分子式 C14H21N3O
分子量 247.3
InChI
InChI Key
Canonical SMILES CN(N=O)[C@H]([C@H](C)CC1)CN1CC2=CC=CC=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
N-Nitroso Tofacitinib Impurity 5 is chemically N-((3R,4R)-1-Benzyl-4-methylpiperidin-3-yl)-N-methylnitrous amide. N-Nitroso Tofacitinib Impurity 5 is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Tofacitinib 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 Tofacitinib. 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.

Tofacitinib Nitroso Impurity 4 CAS#: N/A

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

Identification

英文名 Tofacitinib Nitroso Impurity 4
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-((4R)-4-Methyl-3-(methyl(7-nitroso-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclohexyl)-3-oxopropanenitrile
分子式 C17H20N6O2
分子量 340.4
InChI
InChI Key
Canonical SMILES N#CCC(C1CC(N(C)C2=C3C(N(N=O)C=C3)=NC=N2)[C@H](C)CC1)=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
Tofacitinib Nitroso Impurity 4 is chemically 3-((4R)-4-Methyl-3-(methyl(7-nitroso-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)cyclohexyl)-3-oxopropanenitrile. Tofacitinib Nitroso Impurity 4 is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib Nitroso 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 Tofacitinib. 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.

Tofacitinib Impurity 46 CAS#: 2102039-99-4

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

Identification

英文名 Tofacitinib Impurity 46
分子结构
CAS编号 2102039-99-4
EINECS Number
MDL Number
Beilstein Registry Number
别名 Ethyl 4-cyano-3-imino-5-((3R,4R)-4-methyl-3-((2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-5-oxopentanoate
分子式 C21H27N7O3
分子量 425.5
InChI
InChI Key
Canonical SMILES O=C(OCC)CC(C(C#N)C(N1C[C@H](NC2=C3C(NC=C3)=NC(C)=N2)[C@H](C)CC1)=O)=N

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
Tofacitinib Impurity 46 is chemically Ethyl 4-cyano-3-imino-5-((3R,4R)-4-methyl-3-((2-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-5-oxopentanoate. Tofacitinib Impurity 46 is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib Impurity 46 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 Tofacitinib. 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.

Tofacitinib N-Oxide 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 Tofacitinib N-Oxide Impurity 6
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-((3R,4R)-1-benzyl-4-methylpiperidin-3-yl)-N-methyl-7-nitroso-7H-pyrrolo[2,3-d]pyrimidin-4-amine
分子式 C20H24N6O
分子量 364.5
InChI
InChI Key
Canonical SMILES O=NN1C=CC2=C(N([C@H]3CN(CC4=CC=CC=C4)CC[C@H]3C)C)N=CN=C21

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
Tofacitinib N-Oxide Impurity 6 is chemically N-((3R,4R)-1-benzyl-4-methylpiperidin-3-yl)-N-methyl-7-nitroso-7H-pyrrolo[2,3-d]pyrimidin-4-amine. Tofacitinib N-Oxide Impurity 6 is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib N-Oxide 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 Tofacitinib. 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 Tofacitinib 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 N-Nitroso Tofacitinib Impurity 6
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-((3R,4R)-1-(2-Cyanoacetyl)-4-methylpiperidin-3-yl)-N-methylnitrous amide
分子式 C10H16N4O2
分子量 224.3
InChI
InChI Key
Canonical SMILES O=C(N1CC[C@H]([C@H](C1)N(C)N=O)C)CC#N

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 Tofacitinib Impurity 6 is chemically N-((3R,4R)-1-(2-Cyanoacetyl)-4-methylpiperidin-3-yl)-N-methylnitrous amide. N-Nitroso Tofacitinib Impurity 6 is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Tofacitinib 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 Tofacitinib. 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.

Tofacitinib N-Oxide 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 Tofacitinib N-Oxide Impurity 5
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-methyl-N-((3R,4R)-4-methylpiperidin-3-yl)-7-nitroso-7H-pyrrolo[2,3-d]pyrimidin-4-amine
分子式 C13H18N6O
分子量 274.3
InChI
InChI Key
Canonical SMILES O=NN1C=CC2=C(N(C)[C@H]3CNCC[C@H]3C)N=CN=C21

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
Tofacitinib N-Oxide Impurity 5 is chemically N-methyl-N-((3R,4R)-4-methylpiperidin-3-yl)-7-nitroso-7H-pyrrolo[2,3-d]pyrimidin-4-amine. Tofacitinib N-Oxide Impurity 5 is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib N-Oxide 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 Tofacitinib. 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.

Tofacitinib N-Oxide Impurity 4 CAS#: N/A

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

Identification

英文名 Tofacitinib N-Oxide Impurity 4
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-((3R,4R)-3-((7-hydroxy-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)-4-methylpiperidin-1-yl)-3-oxopropanenitrile
分子式 C15H18N6O2
分子量 314.3
InChI
InChI Key
Canonical SMILES C[C@H]1[C@@H](NC2=NC=NC3=C2C=CN3O)CN(C(CC#N)=O)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
Tofacitinib N-Oxide Impurity 4 is chemically 3-((3R,4R)-3-((7-hydroxy-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)-4-methylpiperidin-1-yl)-3-oxopropanenitrile. Tofacitinib N-Oxide Impurity 4 is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib N-Oxide 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 Tofacitinib. 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.

Tofacitinib 13C D2 15N CAS#: N/A

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

Identification

英文名 Tofacitinib 13C D2 15N
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile-1-13C-2,2-d2-15N
分子式 C1513CH18D2N515NO
分子量 316.4
InChI
InChI Key
Canonical SMILES C[C@H]1[C@H](CN(CC1)C(C([2H])([2H])[13C]#[15N])=O)N(C2=NC=NC3=C2C=CN3)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
Tofacitinib 13C D2 15N is chemically 3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile-1-13C-2,2-d2-15N. Tofacitinib 13C D2 15N is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib 13C D2 15N 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 Tofacitinib. 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.

Tofacitinib N-Oxide 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 Tofacitinib N-Oxide Impurity 2
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-(((3R,4R)-1-(2-cyanoacetyl)-4-methylpiperidin-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidine 3-oxide
分子式 C15H18N6O2
分子量 314.3
InChI
InChI Key
Canonical SMILES C[C@H]1[C@@H](NC2=[N+]([O-])C=NC3=C2C=CN3)CN(C(CC#N)=O)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
Tofacitinib N-Oxide Impurity 2 is chemically 4-(((3R,4R)-1-(2-cyanoacetyl)-4-methylpiperidin-3-yl)amino)-7H-pyrrolo[2,3-d]pyrimidine 3-oxide. Tofacitinib N-Oxide Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib N-Oxide 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 Tofacitinib. 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.

Tofacitinib Impurity 57 CAS#: 2315287-12-6

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

Identification

英文名 Tofacitinib Impurity 57
分子结构
CAS编号 2315287-12-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-Hydroxy-3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-2-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidine-1-carbonyl)pentanedinitrile
分子式 C32H40N12O2
分子量 624.8
InChI
InChI Key
Canonical SMILES OC(CC#N)(N(CC[C@H]1C)C[C@@H]1N(C2=C(C=CN3)C3=NC=N2)C)C(C#N)C(N(CC[C@H]4C)C[C@@H]4N(C5=C(C=CN6)C6=NC=N5)C)=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
Tofacitinib Impurity 57 is chemically 3-Hydroxy-3-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-2-((3R,4R)-4-methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidine-1-carbonyl)pentanedinitrile. Tofacitinib Impurity 57 is supplied with detailed characterization data compliant with regulatory guideline. Tofacitinib Impurity 57 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 Tofacitinib. 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.