5-Chloro-6-(trichloroethenyl)-1,3-dihydro-2H-benzimidazol-2-one
Basic information
- CAS
96474-75-8- Standard SMILES
O=c1[nH]c2cc(Cl)c(C(Cl)=C(Cl)Cl)cc2[nH]1- InChIKey
TZUGFKARKJDEIK-UHFFFAOYSA-N- Molecular formula
- C9H4Cl4N2O
- Average molar mass
- 297.9 g/mol
- Monoisotopic mass
- 295.907774
Names & identifiers
- Preferred name
- 5-Chloro-6-(trichloroethenyl)-1,3-dihydro-2H-benzimidazol-2-one
- IUPAC
- 5-chloro-6-(1,2,2-trichloroethenyl)-1,3-dihydrobenzimidazol-2-one
Names & synonyms
96474-75-8DTXSID605324785-Chloro-6-(trichloroethenyl)-1,3-dihydro-2H-benzimidazol-2-one5-Chloro-6-(1,2,2-trichloroethen-1-yl)-1,3-dihydro-2H-1,3-benzimidazol-2-one
Database identifiers
- CAS
96474-75-8- PubChem CID
- 13257542
- DTXSID
DTXSID60532478
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 342
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Compound notes
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