Basic information
- Standard SMILES
Cc1cc(O)ccc1C(C)(C)c1ccc(O)cc1C- InChIKey
XILNKQWGKMTFFA-UHFFFAOYSA-N- Molecular formula
- C17H20O2
- Average molar mass
- 256.34 g/mol
- Monoisotopic mass
- 256.14632988
Names & identifiers
- Preferred name
- 2,2-Bis(4-hydroxy-2-methylphenyl)propane
- IUPAC
- 4-[2-(4-hydroxy-2-methylphenyl)propan-2-yl]-3-methylphenol
Names & synonyms
2,2-bis(4-hydroxy-2-methylphenyl)propane1940-37-0SCHEMBL440099SCHEMBL29616024DTXSID10553754XILNKQWGKMTFFA-UHFFFAOYSA-N4,4'-(Propane-2,2-diyl)bis(3-methylphenol)
Database identifiers
- CAS
1940-37-0- PubChem CID
- 13981209
- DTXSID
DTXSID10553754
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 272
Related reactions
1 records
Linked notes
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