Einecs 277-568-3
Basic information
- CAS
73688-69-4- Standard SMILES
CC[n+]1c(C)[nH]c2cc([NH3+])ccc21.[Cl-].[Cl-]- InChIKey
QFDZWBFEBAPLOT-UHFFFAOYSA-N- Molecular formula
- C10H15Cl2N3
- Average molar mass
- 248.15 g/mol
- Monoisotopic mass
- 247.0643029
Overview
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Names & identifiers
- Preferred name
- Einecs 277-568-3
- IUPAC
- (1-ethyl-2-methyl-3H-benzimidazol-1-ium-5-yl)azanium dichloride
Names & synonyms
EINECS 277-568-3(1-ethyl-2-methyl-3H-benzimidazol-1-ium-5-yl)azanium;dichloride
Database identifiers
- CAS
73688-69-4- PubChem CID
- 52205
Properties
Computed structural properties
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 183
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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