Methyl 4,5,6,7-tetrahydro-1-benzothiophene-7-carboxylate CAS 110449-91-7

Purity 97%+In StockPharmaceutical Standards
CAS No.110449-91-7
Molecular FormulaC10H12O2S
Molecular Weight196.27 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

Methyl 4,5,6,7-tetrahydro-1-benzothiophene-7-carboxylate CAS 110449-91-7 chemical structure

Description

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

Methyl 4,5,6,7-tetrahydro-1-benzothiophene-7-carboxylate (CAS 110449-91-7), molecular formula C10H12O2S and molecular weight 196.27 g/mol, is a CATO reference standard with documented purity and traceability.

Owing to a sulfone group, a carboxylic acid group, a hydroxyl group, an ether linkage, an aromatic ring system, Methyl 4,5,6,7-tetrahydro-1-benzothiophene-7-carboxylate is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 196.27 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).

As a certified reference material (CRM), Methyl 4,5,6,7-tetrahydro-1-benzothiophene-7-carboxylate meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC10H12O2S
Molecular Weight196.27 g/mol
Purity97%+
StorageStore at 2-8°C
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1988
Sulfur Atoms1

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