550485

3-Oxo-1-cyclopentanecarboxylic acid

97%

• Empirical Formula (Hill Notation): C₆H₈O₃
• CAS Number: 98-78-2
• Molecular Weight: 128.13
• MDL number: MFCD01320173
• UNSPSC Code: 12352100
• PubChem Substance ID: 24879119
• NACRES: NA.22

Properties

• Quality Level: 100
• assay: 97%
• mp: 59-62 °C (lit.)
• functional group: carboxylic acid; ketone
• SMILES string: OC(=O)C1CCC(=O)C1
• InChI: 1S/C6H8O3/c7-5-2-1-4(3-5)6(8)9/h4H,1-3H2,(H,8,9)
• InChI key: RDSNBKRWKBMPOP-UHFFFAOYSA-N

Description

General description

3-Oxo-1-cyclopentanecarboxylic acid , also known as 3-oxocyclopentanecarboxylic acid, is a keto acid derivative. It undergoes Curtius rearrangement with diphenyl phosphoryl azide and triethylamine in tert-butanol to form the corresponding boc-protected 1-(3-oxo)urea derivative.

Application

3-Oxo-1-cyclopentanecarboxylic acid may be used in the preparation of 3-hydroxycyclopentanecarboxylic acid via hydrogenation.

Substrate used in a study of biohydroxylation with mutants of cytochrome P450 BM-3.

Legal Information

Product of Rieke Metals, Inc.
Rieke is a registered trademark of Rieke Metals, Inc.

Safety Information

• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Gloves, type N95 (US)