Bicyclo[3.1.1]heptane-2-carboxylic acid, 2-hydroxy-6,6-dimethyl-
Basic information
- CAS
471-83-0- Standard SMILES
CC1(C)C2CCC(O)(C(=O)O)C1C2- InChIKey
JOVXDZIPAXYGSA-UHFFFAOYSA-N- Molecular formula
- C10H16O3
- Average molar mass
- 184.23 g/mol
- Monoisotopic mass
- 184.10994437
Names & identifiers
- Preferred name
- Bicyclo[3.1.1]heptane-2-carboxylic acid, 2-hydroxy-6,6-dimethyl-
- IUPAC
- 2-hydroxy-6,6-dimethylbicyclo[3.1.1]heptane-2-carboxylic acid
Names & synonyms
471-83-0Bicyclo[3.1.1]heptane-2-carboxylic acid, 2-hydroxy-6,6-dimethyl-NCIOpen2_006942DTXSID203292252-hydroxy-6,6-dimethylbicyclo[3.1.1]heptane-2-carboxylic acid
Database identifiers
- CAS
471-83-0- PubChem CID
- 418559
- DTXSID
DTXSID20329225
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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