Basic information
- Standard SMILES
O=C(O)C(=Cc1ccc(Br)cc1)c1ccc(Cl)cc1Cl- InChIKey
LXMSPDPXCCZKPI-UHFFFAOYSA-N- Molecular formula
- C15H9BrCl2O2
- Average molar mass
- 372 g/mol
- Monoisotopic mass
- 369.9163
Names & identifiers
- Preferred name
- 3-(4-Bromophenyl)-2-(2,4-dichlorophenyl)acrylic acid
- IUPAC
- 3-(4-bromophenyl)-2-(2,4-dichlorophenyl)prop-2-enoic acid
Names & synonyms
SCHEMBL5037421LXMSPDPXCCZKPI-UHFFFAOYSA-N3-(4-bromophenyl)-2-(2,4-dichlorophenyl)acrylic acid
Database identifiers
- PubChem CID
- 69288722
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 378
Related reactions
4 records
Compound notes
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