Basic information
- CAS
93839-15-7- Standard SMILES
CC(=O)OCCn1c(C)nc2cc(Cl)c(Cl)cc21- InChIKey
SNYPYUFXVIJUNY-UHFFFAOYSA-N- Molecular formula
- C12H12Cl2N2O2
- Average molar mass
- 287.14 g/mol
- Monoisotopic mass
- 286.027583
Names & identifiers
- Preferred name
- (5,6-Dichloro-2-methylbenzimidazol-1-yl)-ethyl acetate
- IUPAC
- 2-(5,6-dichloro-2-methylbenzimidazol-1-yl)ethyl acetate
- English name
- (5,6-dichloro-2-methylbenzimidazol-1-yl)-ethyl acetate
- Molecular formula
- C12H12Cl2N2O2
- Molecular weight
- 287.14188
Names & synonyms
93839-15-7(5,6-Dichloro-2-methylbenzimidazol-1-yl)-ethyl acetateEINECS 298-784-4NSC142168DTXSID50239727SNYPYUFXVIJUNY-UHFFFAOYSA-NNSC 142168NSC-142168NS000396582-(5,6-Dichloro-2-methyl-1H-1,3-benzimidazol-1-yl)ethyl acetate5,6-Dichloro-2-methyl-1H-benzimidazole-1-ethanol acetate
Database identifiers
- CAS
93839-15-7- PubChem CID
- 97670
- DTXSID
DTXSID50239727- EC Number
- 298-784-4
- Nikkaji
- J317.597I
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 316
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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