1-Chloro-2-methyl-3-pentyn-2-ol CAS 115823-68-2

Purity 97%+In StockPharmaceutical Standards
CAS No.115823-68-2
Molecular FormulaC6H9ClO
Molecular Weight132.59 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-Chloro-2-methyl-3-pentyn-2-ol CAS 115823-68-2 chemical structure

Description

The occurrence of 1-Chloro-2-methyl-3-pentyn-2-ol is closely related to a hydroxyl group, an ether linkage, chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

1-Chloro-2-methyl-3-pentyn-2-ol (CAS 115823-68-2) is a high-purity analytical reference standard with the molecular formula C6H9ClO and a molecular weight of 132.59 g/mol.

Structurally, 1-Chloro-2-methyl-3-pentyn-2-ol (C6H9ClO) contains a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 2.0, corresponding to approximately 2 ring(s) or double-bond equivalent(s). With a molecular weight of 132.59 g/mol, it falls into the low-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), 1-Chloro-2-methyl-3-pentyn-2-ol 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 FormulaC6H9ClO
Molecular Weight132.59 g/mol
Purity97%+
StorageStore at 2-8°C, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in methanol, acetonitrile, DMSO, water (slightly soluble)
StabilityStable under recommended storage conditions
Degree of Unsaturation (DBE)2.0
CAS Registry Year (est.)1990
Halogen ContentCl-containing

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