2,3,4,5-Tetrahydrobenzo[f][1,4]thiazepine, 97% CAS 58980-39-5

Purity 97%+In StockPharmaceutical Standards
CAS No.58980-39-5
Molecular FormulaC9H11NS
Molecular Weight165.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2,3,4,5-Tetrahydrobenzo[f][1,4]thiazepine, 97% CAS 58980-39-5 chemical structure

Description

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

2,3,4,5-Tetrahydrobenzo[f][1,4]thiazepine, 97% (CAS 58980-39-5), molecular formula C9H11NS and molecular weight 165.26 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 2,3,4,5-Tetrahydrobenzo[f][1,4]thiazepine, 97% (C9H11NS) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 165.26 g/mol, it falls into the medium-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

Physical & Chemical Properties

Molecular FormulaC9H11NS
Molecular Weight165.26 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in methanol, acetonitrile, DMSO
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1973
Nitrogen Atoms1
Sulfur Atoms1

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