Acetic acid--3-methylidenecyclohex-1-en-1-ol (1/1)
Basic information
- CAS
87142-53-8- Standard SMILES
C=C1C=C(O)CCC1.CC(=O)O- InChIKey
IZOJNFYXSFKKAR-UHFFFAOYSA-N- Molecular formula
- C9H14O3
- Average molar mass
- 170.21 g/mol
- Monoisotopic mass
- 170.0942943
Names & identifiers
- Preferred name
- Acetic acid--3-methylidenecyclohex-1-en-1-ol (1/1)
- IUPAC
- acetic acid;3-methylidenecyclohexen-1-ol
Names & synonyms
87142-53-8Acetic acid--3-methylidenecyclohex-1-en-1-ol (1/1)DTXSID50832959
Database identifiers
- CAS
87142-53-8- PubChem CID
- 71413435
- DTXSID
DTXSID50832959
Properties
Computed structural properties
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 164
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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