Basic information
- CAS
72551-10-1- Standard SMILES
C=C(Br)CNCc1ccccc1- InChIKey
VTZNTXQISCQQLW-UHFFFAOYSA-N- Molecular formula
- C10H12BrN
- Average molar mass
- 226.11 g/mol
- Monoisotopic mass
- 225.01531
Names & identifiers
- Preferred name
- N-(2-Bromo-2-propen-1-yl)benzenemethanamine
- IUPAC
- N-benzyl-2-bromoprop-2-en-1-amine
Names & synonyms
BENZYLAMINE, N-(2-BROMOALLYL)-72551-10-1DTXSID30222874RefChem:1090972DTXCID60145365N-(2-Bromo-2-propen-1-yl)benzenemethanamineN-(2-Bromoallyl)benzylamineBRN 4975135N-benzyl-2-bromoprop-2-en-1-amine2-bromo-3(N-benzyl)aminopropeneNCGC00339858-01AB01332599-02
Database identifiers
- CAS
72551-10-1- PubChem CID
- 51618
- DTXSID
DTXSID30222874- Nikkaji
- J69.052J
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 12 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 139
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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