Basic information
- Standard SMILES
C=CCC1CCCCC1=CC(=O)O- InChIKey
WNBPHPPUTNLABS-UHFFFAOYSA-N- Molecular formula
- C11H16O2
- Average molar mass
- 180.24 g/mol
- Monoisotopic mass
- 180.11502975
Names & identifiers
- Preferred name
- 2-(2-Allylcyclohexylidene)acetic acid
- IUPAC
- 2-(2-prop-2-enylcyclohexylidene)acetic acid
Names & synonyms
2-(2-allylcyclohexylidene)acetic acidSCHEMBL15058973WNBPHPPUTNLABS-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 278532
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 228
Related reactions
2 records
Compound notes
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