Basic information
- Standard SMILES
COc1cccc(OC)c1C(=O)C=Cc1c(Cl)cccc1Cl- InChIKey
VBBBZHZBQBUNOK-UHFFFAOYSA-N- Molecular formula
- C17H14Cl2O3
- Average molar mass
- 337.2 g/mol
Names & identifiers
- Preferred name
- 2,6-Dichloro-2',6'-dimethoxychalcone
- IUPAC
- 3-(2,6-dichlorophenyl)-1-(2,6-dimethoxyphenyl)prop-2-en-1-one
Names & synonyms
SCHEMBL981478VBBBZHZBQBUNOK-UHFFFAOYSA-N2,6-dichloro-2',6'-dimethoxychalcone
Database identifiers
- PubChem CID
- 66865879
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 377
Related reactions
2 records
Compound notes
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