Basic information
- Standard SMILES
ClC(Cl)=CCOc1cc(Cl)c(OCCCOc2ccccc2)c(Cl)c1- InChIKey
MKTLLVOYEAMXKH-UHFFFAOYSA-N- Molecular formula
- C18H16Cl4O3
- Average molar mass
- 422.1 g/mol
- Monoisotopic mass
- 419.985355
Names & identifiers
- Preferred name
- 3,5-Dichloro-1-(3,3-dichloro-2-propenyloxy)-4-(3-phenoxypropyloxy)benzene
- IUPAC
- 1,3-dichloro-5-(3,3-dichloroprop-2-enoxy)-2-(3-phenoxypropoxy)benzene
Names & synonyms
SCHEMBL8408702MKTLLVOYEAMXKH-UHFFFAOYSA-N3,5-dichloro-1-(3,3-dichloro-2-propenyloxy)-4-(3-phenoxypropyloxy)benzene
Database identifiers
- PubChem CID
- 54077529
Properties
Computed structural properties
- XLogP
- 6.9
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 386
Related reactions
2 records
Linked notes
Loading…