Basic information
- Standard SMILES
COC(=O)c1cccc2[nH]c(C(Cl)(Cl)Cl)nc12- InChIKey
WYWXIDFXPHBOQN-UHFFFAOYSA-N- Molecular formula
- C10H7Cl3N2O2
- Average molar mass
- 293.5 g/mol
Names & identifiers
- Preferred name
- Methyl-2-trichloromethyl-1H-benzoimidazole-4-carboxylate
- IUPAC
- methyl 2-(trichloromethyl)-1H-benzimidazole-4-carboxylate
Names & synonyms
SCHEMBL3368832WYWXIDFXPHBOQN-UHFFFAOYSA-NMethyl-2-trichloromethyl-1H-benzoimidazole-4-carboxylate2-Trichloromethyl-1H-benzoimidazole-4-carboxylic acid methyl ester
Database identifiers
- PubChem CID
- 23033456
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 308
Related reactions
8 records
Linked notes
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