1-Acetyloxycyclohexane-1-carboxylic acid
Basic information
- CAS
6282-51-5- Standard SMILES
CC(=O)OC1(C(=O)O)CCCCC1- InChIKey
AJKHBTQKPQUKTP-UHFFFAOYSA-N- Molecular formula
- C9H14O4
- Average molar mass
- 186.2 g/mol
- Monoisotopic mass
- 186.08920892
Names & identifiers
- Preferred name
- 1-Acetyloxycyclohexane-1-carboxylic acid
- IUPAC
- 1-acetyloxycyclohexane-1-carboxylic acid
Names & synonyms
1-acetyloxycyclohexane-1-carboxylic acid6282-51-5DTXSID20278305RefChem:227343DTXCID70229463NSC6989NSC-69891-(ACETYLOXY)CYCLOHEXANE-1-CARBOXYLIC ACID
Database identifiers
- CAS
6282-51-5- PubChem CID
- 221883
- DTXSID
DTXSID20278305
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 216
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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