Basic information
- Standard SMILES
CC(CC(C)(CC(C)(C)c1ccc(O)cc1)c1ccc(O)cc1)c1ccc(O)cc1- InChIKey
CIEGINNQDIULCT-UHFFFAOYSA-N- Molecular formula
- C27H32O3
- Average molar mass
- 404.5 g/mol
Names & identifiers
- Preferred name
- 4,6-Dimethyl-2,4,6-tri-(4-hydroxyphenyl)-heptane
- IUPAC
- 4-[4,6-bis(4-hydroxyphenyl)-4,6-dimethylheptan-2-yl]phenol
Names & synonyms
SCHEMBL18139CIEGINNQDIULCT-UHFFFAOYSA-N4,6-dimethyl-2,4,6-tri-(4-hydroxyphenyl)-heptane
Database identifiers
- PubChem CID
- 21894433
Properties
Computed structural properties
- XLogP
- 7.7
- Topological polar surface area
- 60.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 508
Related reactions
3 records
Compound notes
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