Basic information
- CAS
19672-61-8- Standard SMILES
O=C(/C=C/c1ccc(Br)cc1)c1ccc(Cl)cc1- InChIKey
ZSTZCXBJHPAPIQ-XCVCLJGOSA-N- Molecular formula
- C15H10BrClO
- Average molar mass
- 321.59 g/mol
- Monoisotopic mass
- 319.96036
Names & identifiers
- Preferred name
- (2E)-3-(4-bromophenyl)-1-(4-chlorophenyl)prop-2-en-1-one
- IUPAC
- (E)-3-(4-bromophenyl)-1-(4-chlorophenyl)prop-2-en-1-one
Names & synonyms
(2E)-3-(4-bromophenyl)-1-(4-chlorophenyl)prop-2-en-1-one(E)-3-(4-bromophenyl)-1-(4-chlorophenyl)prop-2-en-1-one126443-20-73-(4-bromophenyl)-1-(4-chlorophenyl)prop-2-en-1-oneMFCD000187024-Bromo-4'-chlorochalconeNSC159064CHEMBL5279056SCHEMBL11816853trans-4-Bromo-4'-chlorochalconeZSTZCXBJHPAPIQ-XCVCLJGOSA-NSTK667009
Show more names
AKOS0049099162L-583SNSC-159064NCGC00339507-01ST4082263CS-0334616AB01332566-02(2E)-3-(4-Bromophenyl)-1-(4-chlorophenyl)-2-propen-1-one
Database identifiers
- CAS
19672-61-8- PubChem CID
- 5293153
- ChEMBL
CHEMBL5279056- Nikkaji
- J236.526J
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 300
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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