Basic information
- Standard SMILES
CCCCCc1c(O)ccc(Cl)c1Cl- InChIKey
YKGBEJDKLMAXGW-UHFFFAOYSA-N- Molecular formula
- C11H14Cl2O
- Average molar mass
- 233.13 g/mol
Names & identifiers
- Preferred name
- 2-Pentyl-3,4-dichlorophenol
- IUPAC
- 3,4-dichloro-2-pentylphenol
Names & synonyms
2-pentyl-3,4-dichlorophenolSCHEMBL10636865YKGBEJDKLMAXGW-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 21297280
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 163
Related reactions
1 records
Linked notes
Loading…