1-ethoxy-3-isothiocyanatobenzene CAS 3701-44-8

Purity 97%+In StockPharmaceutical Standards
CAS No.3701-44-8
Molecular FormulaC9H9NOS
Molecular Weight179.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-ethoxy-3-isothiocyanatobenzene CAS 3701-44-8 chemical structure

Description

The occurrence of 1-ethoxy-3-isothiocyanatobenzene is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

CATO supplies 1-ethoxy-3-isothiocyanatobenzene (CAS 3701-44-8), a certified reference material (molecular formula C9H9NOS, MW 179.24 g/mol) for analytical method development and quality control.

Based on its molecular formula C9H9NOS, 1-ethoxy-3-isothiocyanatobenzene contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 179.24 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. 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).

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 1-ethoxy-3-isothiocyanatobenzene 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 FormulaC9H9NOS
Molecular Weight179.24 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1958
Nitrogen Atoms1
Sulfur Atoms1

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