Basic information
- Standard SMILES
O=CC=Cc1cc(Br)cc(Br)c1- InChIKey
FZQOZGFRWASVLB-UHFFFAOYSA-N- Molecular formula
- C9H6Br2O
- Average molar mass
- 289.95 g/mol
- Monoisotopic mass
- 287.87854
Names & identifiers
- Preferred name
- 3-(3',5'-Dibromophenyl)-2-propenal
- IUPAC
- 3-(3,5-dibromophenyl)prop-2-enal
Names & synonyms
SCHEMBL1926354SCHEMBL11047401FZQOZGFRWASVLB-UHFFFAOYSA-N3-(3',5'-dibromophenyl)-2-propenal
Database identifiers
- PubChem CID
- 54059264
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 169
Related reactions
2 records
Compound notes
Loading…