2-((7H-Purin-6-yl)thio)acetonitrile CAS 5443-91-4

Purity 97%+In StockPharmaceutical Standards
CAS No.5443-91-4
Molecular FormulaC7H5N5S
Molecular Weight191.21 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

2-((7H-Purin-6-yl)thio)acetonitrile CAS 5443-91-4 chemical structure

Description

CATO supplies 2-((7H-Purin-6-yl)thio)acetonitrile (CAS 5443-91-4), a certified reference material (molecular formula C7H5N5S, MW 191.21 g/mol) for analytical method development and quality control.

Structurally, 2-((7H-Purin-6-yl)thio)acetonitrile (C7H5N5S) contains a nitrile group, sulfur-containing functionality, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 8.0, corresponding to approximately 8 ring(s) or double-bond equivalent(s). With a molecular weight of 191.21 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.

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.

Physical & Chemical Properties

Molecular FormulaC7H5N5S
Molecular Weight191.21 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1958
Nitrogen Atoms5
Sulfur Atoms1

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