Basic information
- CAS
73688-68-3- Standard SMILES
C=CC[n+]1c(N)n(CC)c2ccccc21.[Br-]- InChIKey
WYUQJKBEYPKSFO-UHFFFAOYSA-N- Molecular formula
- C12H16BrN3
- Average molar mass
- 282.18 g/mol
- Monoisotopic mass
- 281.05276
Names & identifiers
- Preferred name
- 1-Ethyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-benzimidazol-2-imine--hydrogen bromide (1/1)
- IUPAC
- 1-ethyl-3-prop-2-enylbenzimidazol-3-ium-2-amine bromide
Names & synonyms
73688-68-3RefChem:1055429DTXCID5014215771-Ethyl-3-(prop-2-en-1-yl)-1,3-dihydro-2H-benzimidazol-2-imine--hydrogen bromide (1/1)DTXSID309945443-Allyl-2-amino-1-ethylbenzimidazole bromideBENZIMIDAZOLE, 3-ALLYL-2-AMINO-1-ETHYL-, BROMIDE
Database identifiers
- CAS
73688-68-3- PubChem CID
- 52203
Properties
Computed structural properties
- Topological polar surface area
- 34.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 229
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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