5-Chloro-1-(4-phenylbutan-2-yl)-1H-benzo[d]imidazole-2-thiol CAS 442644-30-6

Purity 97%+In StockPharmaceutical Standards
CAS No.442644-30-6
Molecular FormulaC17H17ClN2S
Molecular Weight316.85 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-Chloro-1-(4-phenylbutan-2-yl)-1H-benzo[d]imidazole-2-thiol CAS 442644-30-6 chemical structure

Description

5-Chloro-1-(4-phenylbutan-2-yl)-1H-benzo[d]imidazole-2-thiol (CAS 442644-30-6) is a high-purity analytical reference standard with the molecular formula C17H17ClN2S and a molecular weight of 316.85 g/mol.

Structurally, 5-Chloro-1-(4-phenylbutan-2-yl)-1H-benzo[d]imidazole-2-thiol (C17H17ClN2S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 316.85 g/mol, it falls into the moderately-high-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.

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.

CATO manufactures 5-Chloro-1-(4-phenylbutan-2-yl)-1H-benzo[d]imidazole-2-thiol under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC17H17ClN2S
Molecular Weight316.85 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)10.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl-containing
Nitrogen Atoms2
Sulfur Atoms1

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