Basic information
- Standard SMILES
CCC(CC(CC)c1ccc(O)cc1)c1ccc(O)cc1- InChIKey
RMHBBOJSJLXDKB-UHFFFAOYSA-N- Molecular formula
- C19H24O2
- Average molar mass
- 284.4 g/mol
Names & identifiers
- Preferred name
- 3,5-Bis(4-hydroxyphenyl) heptane
- IUPAC
- 4-[5-(4-hydroxyphenyl)heptan-3-yl]phenol
Names & synonyms
RMHBBOJSJLXDKB-UHFFFAOYSA-N3,5-bis(4-hydroxyphenyl) heptaneNS00004256
Database identifiers
- PubChem CID
- 85634817
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 247
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Related reactions
1 records
Compound notes
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