Basic information
- CAS
3198-23-0- Standard SMILES
O=C([O-])C1CCCCC1- InChIKey
NZNMSOFKMUBTKW-UHFFFAOYSA-M- Molecular formula
- C7H11O2-
- Average molar mass
- 127.16 g/mol
- Monoisotopic mass
- 127.07645317
Overview
Cyclohexanecarboxylate is a monocarboxylic acid anion that is the conjugate base of cyclohexanecarboxylic acid. It is a conjugate base of a cyclohexanecarboxylic acid.
Names & identifiers
- Preferred name
- Cyclohexanecarboxylate
- IUPAC
- cyclohexanecarboxylate
Names & synonyms
CyclohexanecarboxylateCCRIS 7682Cyclohexanecarboxylic acid, ion(1-)CHEBI:27804DTXSID50953870RefChem:129563DTXCID3013819113198-23-0NZNMSOFKMUBTKW-UHFFFAOYSA-MQ27103345
Database identifiers
- CAS
3198-23-0- PubChem CID
- 168965
- DTXSID
DTXSID50953870- ChEBI
CHEBI:27804
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 40.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- -1
- Complexity
- 98
Related reactions
2 records
Compound notes
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