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Basic information
- CAS
20559-96-0- Standard SMILES
C[NH+](C)CCSc1[nH]c2ccccc2[nH+]1.[Br-].[Br-]- InChIKey
MIIPKLISSVWTDO-UHFFFAOYSA-N- Molecular formula
- C11H17Br2N3S
- Average molar mass
- 383.15 g/mol
- Monoisotopic mass
- 380.95099
Names & identifiers
- Preferred name
- Benzimidazole, 2-((2-(dimethylamino)ethyl)thio)-, dihydrobromide
- IUPAC
- 2-(1H-benzimidazol-3-ium-2-ylsulfanyl)ethyl-dimethylazanium dibromide
Names & synonyms
2-(2'-Dimethylaminoethylthio)benzimidazoline bromide hydrobromide20559-96-02-((2-(Dimethylamino)ethyl)thio)benzimidazole dihydrobromideBENZIMIDAZOLE, 2-((2-(DIMETHYLAMINO)ETHYL)THIO)-, DIHYDROBROMIDERefChem:325837
Database identifiers
- CAS
20559-96-0- PubChem CID
- 30183
Properties
Computed structural propertiesFilling in
- Topological polar surface area
- 59.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
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Compound notes
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