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4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carboxylic acid, 97%, Thermo Scientific Chemicals

Catalog No. AAH3306206
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It is used as pharmaceutical intermediate. Benzoylthiophenes are allosteric enhancers (AE) of agonist activity at the A1 adenosine receptor.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
It is used as pharmaceutical intermediate. Benzoylthiophenes are allosteric enhancers (AE) of agonist activity at the A1 adenosine receptor.

Solubility
Sparingly soluble in water.(0.26 g/L) (25°C),

Notes
Store in cool dry place. Ensure proper ventilation. Incompatible with oxidizing agents.

Chemical Identifiers

CAS

40133-07-1

Molecular Formula

C9H10O2S

Molecular Weight (g/mol)

182.237

MDL Number

MFCD00464469

InChI Key

ROLXOQXKNDKXTA-UHFFFAOYSA-N

Synonym

4,5,6,7-tetrahydrobenzo b thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro-benzo b thiophene-2-carboxylic acid, benzo b thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro, acmc-1asbb, enamine_001826, 2-carboxy-4,5,6,7-tetrahydro-1-benzothiophene, 2-carboxy-4,5,6,7-tetrahydrobenzo b thiophene, 4,5,6,7-tetrahydrobenzo b thiophene-2-carboxylicacid, 4,5,6,7-tetrahydrobenzo b-thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro-benzo b thiophene-2-carboxylic

PubChem CID

2063443

IUPAC Name

4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid

SMILES

C1CCC2=C(C1)C=C(S2)C(=O)O

Specifications

Melting Point

191°C to 193°C

Quantity

5 g

Solubility Information

Sparingly soluble in water.(0.26g/L) (25°C),

Formula Weight

182.24

Percent Purity

97%

Chemical Name or Material

4,5,6,7-Tetrahydrobenzo[b]thiophene-2-carboxylic acid

Hazard Category

H315-H319-H335

Hazard Statement

GHS H Statement
H315-H319-H335
Causes skin irritation.
Causes serious eye irritation.
May cause respiratory irritation.

Precautionary Statement

P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P501c

TSCA

No

Recommended Storage

Ambient temperatures
SDS

RUO – Research Use Only

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