4-((Allyloxy)methyl)-3-fluorobenzenethiol CAS 1379212-76-6

Purity 97%+In StockPharmaceutical Standards
CAS No.1379212-76-6
Molecular FormulaC10H11FOS
Molecular Weight198.26 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

4-((Allyloxy)methyl)-3-fluorobenzenethiol CAS 1379212-76-6 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 198.26 g/mol gives 4-((Allyloxy)methyl)-3-fluorobenzenethiol distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

4-((Allyloxy)methyl)-3-fluorobenzenethiol (CAS 1379212-76-6), molecular formula C10H11FOS and molecular weight 198.26 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 4-((Allyloxy)methyl)-3-fluorobenzenethiol (C10H11FOS) contains sulfur-containing functionality, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system. 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 198.26 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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.

As a certified reference material (CRM), 4-((Allyloxy)methyl)-3-fluorobenzenethiol meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC10H11FOS
Molecular Weight198.26 g/mol
Purity97%+
StorageStore at 2-8°C, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure
Degree of Unsaturation (DBE)5.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1991
Halogen ContentF-containing
Sulfur Atoms1

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