4-Bromo-1,3-diphenylbut-2-en-1-one
Basic information
- CAS
5247-74-5- Standard SMILES
O=C(C=C(CBr)c1ccccc1)c1ccccc1- InChIKey
GTWVKXCFFOTWRQ-UHFFFAOYSA-N- Molecular formula
- C16H13BrO
- Average molar mass
- 301.18 g/mol
- Monoisotopic mass
- 300.01498
Names & identifiers
- Preferred name
- 4-Bromo-1,3-diphenylbut-2-en-1-one
- IUPAC
- 4-bromo-1,3-diphenylbut-2-en-1-one
Names & synonyms
5247-74-54-bromo-1,3-diphenylbut-2-en-1-one4-bromo-1,3-diphenyl-2-buten-1-oneDTXSID10966906
Database identifiers
- CAS
5247-74-5- PubChem CID
- 344968
- DTXSID
DTXSID10966906
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 296
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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