1-(Hexahydro-2,5-methanopentalen-3a(1H)-yl)ethan-1-one CAS 29844-80-2

Purity 97%+In StockPharmaceutical Standards
CAS No.29844-80-2
Molecular FormulaC11H16O
Molecular Weight164.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

1-(Hexahydro-2,5-methanopentalen-3a(1H)-yl)ethan-1-one CAS 29844-80-2 chemical structure

Description

1-(Hexahydro-2,5-methanopentalen-3a(1H)-yl)ethan-1-one (CAS 29844-80-2), molecular formula C11H16O and molecular weight 164.24 g/mol, is a CATO reference standard with documented purity and traceability.

Structurally, 1-(Hexahydro-2,5-methanopentalen-3a(1H)-yl)ethan-1-one (C11H16O) contains a hydroxyl group, an ether linkage, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 4.0, corresponding to approximately 4 ring(s) or double-bond equivalent(s). With a molecular weight of 164.24 g/mol, it falls into the medium-molecular-weight range. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.

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.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC11H16O
Molecular Weight164.24 g/mol
Purity97%+
StorageStore at 2-8°C
Solubility (reference)Soluble in chloroform, dichloromethane, ethyl acetate, DMSO
StabilityStable under recommended storage conditions
Degree of Unsaturation (DBE)4.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1965

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