Cyclopentanecarboxylic acid, 2-methylene-3-oxo-
Basic information
- CAS
72581-31-8- Standard SMILES
C=C1C(=O)CCC1C(=O)O- InChIKey
ILFPCMXTASDZKM-UHFFFAOYSA-N- Molecular formula
- C7H8O3
- Average molar mass
- 140.14 g/mol
- Monoisotopic mass
- 140.04734411
Names & identifiers
- Preferred name
- Cyclopentanecarboxylic acid, 2-methylene-3-oxo-
- IUPAC
- 2-methylidene-3-oxocyclopentane-1-carboxylic acid
Names & synonyms
874-21-5Cyclopentanecarboxylic acid, 2-methylene-3-oxo-NSC143472-methylidene-3-oxocyclopentane-1-carboxylic acidSCHEMBL596950CHEMBL2008585AKOS006377430NCI60_0009552-methylene-3-oxo-cyclopentanecarboxylic acid
Database identifiers
- CAS
72581-31-8- PubChem CID
- 70124
- ChEMBL
CHEMBL2008585- Nikkaji
- J175.453J
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 54.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 205
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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