Basic information
- CAS
67522-25-2- Standard SMILES
CC1(C)C=C(C(=O)O)C(C)(C)C1- InChIKey
CLJPAQNIJHYUJX-UHFFFAOYSA-N- Molecular formula
- C10H16O2
- Average molar mass
- 168.23 g/mol
- Monoisotopic mass
- 168.11502975
Names & identifiers
- Preferred name
- 3,3,5,5-Tetramethylcyclopent-1-ene-1-carboxylic acid
- IUPAC
- 3,3,5,5-tetramethylcyclopentene-1-carboxylic acid
Names & synonyms
67522-25-23,3,5,5-Tetramethylcyclopent-1-ene-1-carboxylic acidDTXSID60498888
Database identifiers
- CAS
67522-25-2- PubChem CID
- 12453045
- DTXSID
DTXSID60498888
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 247
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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