Tiagabine Diol Analog CAS#: 2125725-84-8

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

Identification

英文名 Tiagabine Diol Analog
分子结构
CAS编号 2125725-84-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 (3R)-1-[3,4-Dihydroxy-4,4-bis(3-methylthiophen-2-yl)butyl]piperidine-3-carboxylic acid (as per USP)
分子式 C20H27NO4S2
分子量 409.6
InChI
InChI Key
Canonical SMILES O=C([C@H]1CN(CCC(O)C(C2=C(C)C=CS2)(C3=C(C)C=CS3)O)CCC1)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
Tiagabine Diol Analog is chemically (3R)-1-[3,4-Dihydroxy-4,4-bis(3-methylthiophen-2-yl)butyl]piperidine-3-carboxylic acid (as per USP). Tiagabine Diol Analog is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine Diol Analog 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 Tiagabine. 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.

Desmethyl Tiagabine (USP) CAS#: 745762-44-1

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

Identification

英文名 Desmethyl Tiagabine (USP)
分子结构
CAS编号 745762-44-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 (R)-1-[4-(3-Methyl-2-thienyl)-4-(2-thienyl)-3-butenyl]-3-piperidine carboxylic acid
分子式 C19H23NO2S2
分子量 361.5
InChI
InChI Key
Canonical SMILES O=C([C@H]1CN(CC/C=C(C2=C(C)C=CS2)/C3=CC=CS3)CCC1)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
Desmethyl Tiagabine (USP) is chemically (R)-1-[4-(3-Methyl-2-thienyl)-4-(2-thienyl)-3-butenyl]-3-piperidine carboxylic acid . Desmethyl Tiagabine (USP) is supplied with detailed characterization data compliant with regulatory guideline. Desmethyl Tiagabine (USP) 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 Tiagabine. 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.

Tiagabine Methyl Ester Impurity (USP) CAS#: 938158-99-7

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

Identification

英文名 Tiagabine Methyl Ester Impurity (USP)
分子结构
CAS编号 938158-99-7
EINECS Number
MDL Number
Beilstein Registry Number
别名 Methyl (R)-1-[4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl]piperidine-3-carboxylate (as per USP)
分子式 C21H27NO2S2
分子量 389.6
InChI
InChI Key
Canonical SMILES O=C([C@H]1CN(CC/C=C(C2=C(C)C=CS2)/C3=C(C)C=CS3)CCC1)OC

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
Tiagabine Methyl Ester Impurity (USP) is chemically Methyl (R)-1-[4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl]piperidine-3-carboxylate (as per USP). Tiagabine Methyl Ester Impurity (USP) is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine Methyl Ester Impurity (USP) 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 Tiagabine. 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.

Tiagabine D4 CAS#: N/A

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

Identification

英文名 Tiagabine D4
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (3R)-1-(4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl)piperidine-3-carboxylic-2,4,5,6-d4 acid
分子式 C20H21D4NO2S2
分子量 379.6
InChI
InChI Key
Canonical SMILES CC1=C(SC=C1)/C(C(SC=C2)=C2C)=CCCN(C([2H])C([2H])C3[2H])C([2H])[C@@H]3C(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 115103-54-3 (Unlabeled)
Use Pattern
Tiagabine D4 is chemically (3R)-1-(4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl)piperidine-3-carboxylic-2,4,5,6-d4 acid. Tiagabine D4 is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine D4 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 Tiagabine. 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.

Tiagabine Keto Analog CAS#: 161014-55-7

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

Identification

英文名 Tiagabine Keto Analog
分子结构
CAS编号 161014-55-7
EINECS Number
MDL Number
Beilstein Registry Number
别名 (R)-1-[4,4-Bis(3-methylthiophen-2-yl)-3-oxobutyl]piperidine-3-carboxylic acid (as per USP)
分子式 C20H25NO3S2
分子量 391.5
InChI
InChI Key
Canonical SMILES O=C([C@H]1CN(CCC(C(C2=C(C)C=CS2)C3=C(C)C=CS3)=O)CCC1)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
Tiagabine Keto Analog is chemically (R)-1-[4,4-Bis(3-methylthiophen-2-yl)-3-oxobutyl]piperidine-3-carboxylic acid (as per USP). Tiagabine Keto Analog is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine Keto Analog 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 Tiagabine. 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.

Tiagabine Impurity 1 CAS#: 2124269-35-6

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

Identification

英文名 Tiagabine Impurity 1
分子结构
CAS编号 2124269-35-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 (3S)-1-(3,4-dihydroxy-4,4-bis(3-methylthiophen-2-yl)butyl)piperidine-3-carboxylic acid
分子式 C20H27NO4S2
分子量 409.6
InChI
InChI Key
Canonical SMILES O=C([C@@H]1CN(CCC(O)C(C2=C(C)C=CS2)(O)C3=C(C)C=CS3)CCC1)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
Tiagabine Impurity 1 is chemically (3S)-1-(3,4-dihydroxy-4,4-bis(3-methylthiophen-2-yl)butyl)piperidine-3-carboxylic acid. Tiagabine Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine 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 Tiagabine. 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.

Bisthiophenyl Tetrahydrofuran (USP) CAS#: 1253297-73-2

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

Identification

英文名 Bisthiophenyl Tetrahydrofuran (USP)
分子结构
CAS编号 1253297-73-2
EINECS Number
MDL Number
Beilstein Registry Number
别名 2,2-Bis(3-methyl-2-thienyl) tetrahydrofuran (as per USP)
分子式 C14H16OS2
分子量 264.4
InChI
InChI Key
Canonical SMILES CC1=C(C2(C3=C(C)C=CS3)OCCC2)SC=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
Bisthiophenyl Tetrahydrofuran (USP) is chemically 2,2-Bis(3-methyl-2-thienyl) tetrahydrofuran (as per USP). Bisthiophenyl Tetrahydrofuran (USP) is supplied with detailed characterization data compliant with regulatory guideline. Bisthiophenyl Tetrahydrofuran (USP) 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 Tiagabine. 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.

Tiagabine Alcohol Analog (USP) CAS#: 847233-27-6

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

Identification

英文名 Tiagabine Alcohol Analog (USP)
分子结构
CAS编号 847233-27-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 4,4-Bis(3-methyl-2-thienyl)-3-buten-1-ol (as per USP)
分子式 C14H16OS2
分子量 264.4
InChI
InChI Key
Canonical SMILES OCC/C=C(C1=C(C)C=CS1)/C2=C(C)C=CS2

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
Tiagabine Alcohol Analog (USP) is chemically 4,4-Bis(3-methyl-2-thienyl)-3-buten-1-ol (as per USP). Tiagabine Alcohol Analog (USP) is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine Alcohol Analog (USP) 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 Tiagabine. 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.

Tiagabine D6 CAS#: 1217672-34-8

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

Identification

英文名 Tiagabine D6
分子结构
CAS编号 1217672-34-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 (R)-1-(4,4-bis(3-(methyl-d3)thiophen-2-yl)but-3-en-1-yl)piperidine-3-carboxylic acid
分子式 C20H19D6NO2S2
分子量 381.6
InChI
InChI Key
Canonical SMILES OC([C@H]1CN(CCC1)CC/C=C(C(SC=C2)=C2C([2H])([2H])[2H])/C(SC=C3)=C3C([2H])([2H])[2H])=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
Tiagabine D6 is chemically (R)-1-(4,4-bis(3-(methyl-d3)thiophen-2-yl)but-3-en-1-yl)piperidine-3-carboxylic acid. Tiagabine D6 is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine D6 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 Tiagabine. 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.

Tiagabine Hydrochloride CAS#: 145821-59-6

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

Identification

英文名 Tiagabine Hydrochloride
分子结构
CAS编号 145821-59-6
EINECS Number
MDL Number
Beilstein Registry Number
别名 (R)-1-(4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl)piperidine-3-carboxylic acid hydrochloride
分子式 C20H25NO2S2 : HCl
分子量 376.0 : 36.5
InChI
InChI Key
Canonical SMILES CC1=C(SC=C1)/C(C(SC=C2)=C2C)=C/CCN(CCC3)C[C@@H]3C(O)=O.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 115103-54-3 (free base)
Use Pattern
Tiagabine Hydrochloride is chemically (R)-1-(4,4-bis(3-methylthiophen-2-yl)but-3-en-1-yl)piperidine-3-carboxylic acid hydrochloride. Tiagabine Hydrochloride is supplied with detailed characterization data compliant with regulatory guideline. Tiagabine Hydrochloride 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 Tiagabine. 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.