2-Acetamido-3-(4-bromophenyl)prop-2-enoic acid
Basic information
- CAS
194149-50-3- Standard SMILES
CC(=O)NC(=Cc1ccc(Br)cc1)C(=O)O- InChIKey
PTEZWGHXLACFOP-UHFFFAOYSA-N- Molecular formula
- C11H10BrNO3
- Average molar mass
- 284.11 g/mol
- Monoisotopic mass
- 282.98441
Names & identifiers
- Preferred name
- 2-Acetamido-3-(4-bromophenyl)prop-2-enoic acid
- IUPAC
- 2-acetamido-3-(4-bromophenyl)prop-2-enoic acid
Names & synonyms
2-acetamido-3-(4-bromophenyl)prop-2-enoic acid194149-50-3Maybridge3_007629DTXSID60372639
Database identifiers
- CAS
194149-50-3- PubChem CID
- 2747232
- DTXSID
DTXSID60372639
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 306
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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