6-(1,1-Dimethylethyl)bicyclo[2.2.1]heptan-2-ol
Basic information
- CAS
274907-06-1- Standard SMILES
CC(C)(C)C1CC2CC(O)C1C2- InChIKey
DDLJRDQVSQJFMP-UHFFFAOYSA-N- Molecular formula
- C11H20O
- Average molar mass
- 168.28 g/mol
- Monoisotopic mass
- 168.15141526
Names & identifiers
- Preferred name
- 6-(1,1-Dimethylethyl)bicyclo[2.2.1]heptan-2-ol
- IUPAC
- 6-tert-butylbicyclo[2.2.1]heptan-2-ol
Names & synonyms
274907-06-16-(1,1-Dimethylethyl)bicyclo[2.2.1]heptan-2-ol6-(1,1-Dimethylethyl)bicyclo(2.2.1)heptan-2-olRefChem:306431Bicyclo[2.2.1]heptan-2-ol, 6-tert-butyl-DDLJRDQVSQJFMP-UHFFFAOYSA-NDTXSID5012475436-tert-Butylbicyclo[2.2.1]heptan-2-ol6-tert-Butylbicyclo[2.2.1]heptan-2-ol #
Database identifiers
- CAS
274907-06-1- PubChem CID
- 549167
- DTXSID
DTXSID501247543
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 180
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Compound notes
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