Basic information
- CAS
131432-92-3- Standard SMILES
C[C@H](Br)C(=O)NCc1ccccc1- InChIKey
TVHQJFAUJYBAAE-QMMMGPOBSA-N- Molecular formula
- C10H12BrNO
- Average molar mass
- 242.11 g/mol
- Monoisotopic mass
- 241.01023
Names & identifiers
- Preferred name
- (S)-2-Bromo-N-benzylpropanamide
- IUPAC
- (2S)-N-benzyl-2-bromopropanamide
Names & synonyms
(S)-2-Bromo-N-benzylpropanamide131432-92-3CCRIS 5666(S)-2-Bromo-N-(phenylmethyl)propanamidePropanamide, 2-bromo-N-(phenylmethyl)-, (S)-
Database identifiers
- CAS
131432-92-3- PubChem CID
- 154352
- Nikkaji
- J1.139.973H
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 166
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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