(1S,2R,3aR,6aS)-1-(Hydroxymethyl)-5-oxooctahydropentalen-2-yl benzoate CAS 74842-93-6

Purity 97%+In StockPharmaceutical Standards
CAS No.74842-93-6
Molecular FormulaC16H18O4
Molecular Weight274.31 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

(1S,2R,3aR,6aS)-1-(Hydroxymethyl)-5-oxooctahydropentalen-2-yl benzoate CAS 74842-93-6 chemical structure

Description

Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including (1S,2R,3aR,6aS)-1-(Hydroxymethyl)-5-oxooctahydropentalen-2-yl benzoate.

(1S,2R,3aR,6aS)-1-(Hydroxymethyl)-5-oxooctahydropentalen-2-yl benzoate (CAS 74842-93-6), molecular formula C16H18O4 and molecular weight 274.31 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, (1S,2R,3aR,6aS)-1-(Hydroxymethyl)-5-oxooctahydropentalen-2-yl benzoate (C16H18O4) contains a flavonoid core, a hydroxyl group, an ether linkage. 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 274.31 g/mol, it falls into the medium-molecular-weight range. 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).

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

CATO manufactures (1S,2R,3aR,6aS)-1-(Hydroxymethyl)-5-oxooctahydropentalen-2-yl benzoate 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 FormulaC16H18O4
Molecular Weight274.31 g/mol
AppearancePale yellow to yellow crystalline powder
Purity97%+
StorageStore at 2-8°C, protect from light, keep sealed and dry
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)8.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1978

Recommended Standards

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