Basic information
- CAS
59194-97-7- Standard SMILES
CC(Br)C(=O)c1ccc(-c2ccc(Cl)cc2)o1- InChIKey
YSLQOKAZZUZMIE-UHFFFAOYSA-N- Molecular formula
- C13H10BrClO2
- Average molar mass
- 313.57 g/mol
- Monoisotopic mass
- 311.95527
Names & identifiers
- Preferred name
- 1-Propanone, 2-bromo-1-[5-(4-chlorophenyl)-2-furanyl]-
- IUPAC
- 2-bromo-1-[5-(4-chlorophenyl)furan-2-yl]propan-1-one
Names & synonyms
59194-97-72-bromo-1-[5-(4-chlorophenyl)furan-2-yl]propan-1-one1-Propanone, 2-bromo-1-[5-(4-chlorophenyl)-2-furanyl]-DTXSID104823535-(p-chlorophenyl)-2-(a-bromopropionyl)furan
Database identifiers
- CAS
59194-97-7- PubChem CID
- 12249596
- DTXSID
DTXSID10482353
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 277
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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