Basic information
- CAS
111085-77-9- Standard SMILES
CC1=CC2OC3(C)CC(O)CC3(C)C2(C)CC1- InChIKey
AEVRZHUASKUUBI-UHFFFAOYSA-N- Molecular formula
- C15H24O2
- Average molar mass
- 236.35 g/mol
- Monoisotopic mass
- 236.17763
Names & identifiers
- Preferred name
- 1H-Cyclopenta(b)benzofuran-2-ol, 2,3,3a,4a,7,8,8a,8b-octahydro-3a,6,8a,8b-tetramethyl-
- IUPAC
- 3a,6,8a,8b-tetramethyl-1,2,3,4a,7,8-hexahydrocyclopenta[b][1]benzofuran-2-ol
Names & synonyms
111085-77-91H-Cyclopenta(b)benzofuran-2-ol, 2,3,3a,4a,7,8,8a,8b-octahydro-3a,6,8a,8b-tetramethyl-DTXSID209119873a,6,8a,8b-Tetramethyl-2,3,3a,4a,7,8,8a,8b-octahydro-1H-benzo[b]cyclopenta[d]furan-2-ol
Database identifiers
- CAS
111085-77-9- PubChem CID
- 183166
- DTXSID
DTXSID20911987
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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