Basic information
- CAS
7673-88-3- Standard SMILES
[Br-].[Br-].[NH3+]CCSc1[nH]c2ccccc2[nH+]1- InChIKey
LHUYEDYSUAZWOJ-UHFFFAOYSA-N- Molecular formula
- C9H13Br2N3S
- Average molar mass
- 355.1 g/mol
- Monoisotopic mass
- 352.91969
Names & identifiers
- Preferred name
- Benzimidazole, 2-((2-aminoethyl)thio)-, dihydrobromide
- IUPAC
- 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethylazanium dibromide
Names & synonyms
2-(2-Aminoethylmercapto)benzimidazoline bromide hydrobromideBENZIMIDAZOLE, 2-((2-AMINOETHYL)THIO)-, DIHYDROBROMIDE2-((2-Aminoethyl)thio)benzimidazole dihydrobromideRefChem:3258387673-88-3
Database identifiers
- CAS
7673-88-3- PubChem CID
- 24323
Properties
Computed structural properties
- Topological polar surface area
- 82.9 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 151
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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