1-fluoro-4-(2-isothiocyanatoethyl)benzene CAS 2740-86-5

Purity 97%+In StockPharmaceutical Standards
CAS No.2740-86-5
Molecular FormulaC9H8FNS
Molecular Weight181.23 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-fluoro-4-(2-isothiocyanatoethyl)benzene CAS 2740-86-5 chemical structure

Description

CATO manufactures 1-fluoro-4-(2-isothiocyanatoethyl)benzene 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.

1-fluoro-4-(2-isothiocyanatoethyl)benzene (CAS 2740-86-5) is a high-purity analytical reference standard with the molecular formula C9H8FNS and a molecular weight of 181.23 g/mol.

The molecular framework of 1-fluoro-4-(2-isothiocyanatoethyl)benzene (C9H8FNS) is characterized by a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. 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 FormulaC9H8FNS
Molecular Weight181.23 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1957
Halogen ContentF-containing
Nitrogen Atoms1
Sulfur Atoms1

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