Basic information
- Standard SMILES
O=C(CCCCCO)c1ccc(-c2ccc(Cl)cc2Cl)cc1- InChIKey
ABHWKVKVDHFWPT-UHFFFAOYSA-N- Molecular formula
- C18H18Cl2O2
- Average molar mass
- 337.2 g/mol
Names & identifiers
- Preferred name
- 1-(2',4'-Dichloro-biphenyl-4-yl)-6-hydroxy-hexan-1-one
- IUPAC
- 1-[4-(2,4-dichlorophenyl)phenyl]-6-hydroxyhexan-1-one
Names & synonyms
1055896-19-91-(2',4'-Dichloro-[1,1'-biphenyl]-4-yl)-6-hydroxyhexan-1-one1-(2',4'-Dichloro-biphenyl-4-yl)-6-hydroxy-hexan-1-onestarbld0020489ABD328SCHEMBL4296986CHEMBL1224326ABHWKVKVDHFWPT-UHFFFAOYSA-N1-[4-(2,4-dichlorophenyl)phenyl]-6-hydroxyhexan-1-one
Database identifiers
- PubChem CID
- 24896595
- ChEMBL
CHEMBL1224326
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 340
Related reactions
4 records
Compound notes
Loading…