Basic information
- CAS
21340-43-2- Standard SMILES
C=CC[NH+](CC=C)CC(=O)Nc1cccc(Br)c1.[Cl-]- InChIKey
WRXNLOHLMOLHAK-UHFFFAOYSA-N- Molecular formula
- C14H18BrClN2O
- Average molar mass
- 345.66 g/mol
- Monoisotopic mass
- 344.0291
Names & identifiers
- Preferred name
- Acetanilide, 3'-bromo-2-(diallylamino)-, monohydrochloride
- IUPAC
- [2-(3-bromoanilino)-2-oxoethyl]-bis(prop-2-enyl)azanium chloride
Names & synonyms
3'-Bromo-2-diallylaminoacetanilide hydrochloride21340-43-2ACETANILIDE, 3'-BROMO-2-(DIALLYLAMINO)-, MONOHYDROCHLORIDERefChem:315773
Database identifiers
- CAS
21340-43-2- PubChem CID
- 30599
Properties
Computed structural properties
- Topological polar surface area
- 33.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 284
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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