Basic information
- CAS
3788-29-2- Standard SMILES
CC1(c2ccc(O)cc2)CC(C)(c2ccc(O)cc2)C1- InChIKey
CFAKKBWNWRAHPW-UHFFFAOYSA-N- Molecular formula
- C18H20O2
- Average molar mass
- 268.3 g/mol
- Monoisotopic mass
- 268.14632988
Names & identifiers
- Preferred name
- 4,4'-(1,3-Dimethylcyclobutane-1,3-diyl)diphenol
- IUPAC
- 4-[3-(4-hydroxyphenyl)-1,3-dimethylcyclobutyl]phenol
Names & synonyms
3788-29-2NSC4028864,4'-(1,3-Dimethylcyclobutane-1,3-diyl)diphenolCHEMBL1795602DTXSID10331251NSC-402886
Database identifiers
- CAS
3788-29-2- PubChem CID
- 436731
- DTXSID
DTXSID10331251- ChEMBL
CHEMBL1795602
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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