Basic information
- CAS
77966-40-6- Standard SMILES
Cc1cccc(Cl)c1NC(=O)C[NH2+]C1CCCCC1.[Cl-]- InChIKey
QSKIPSDWIWHXFN-UHFFFAOYSA-N- Molecular formula
- C15H22Cl2N2O
- Average molar mass
- 317.3 g/mol
- Monoisotopic mass
- 316.1109187
Names & identifiers
- Preferred name
- N-(2-Chloro-6-methylphenyl)-2-(cyclohexylamino)ethanimidic acid--hydrogen chloride (1/1)
- IUPAC
- [2-(2-chloro-6-methylanilino)-2-oxoethyl]-cyclohexylazanium chloride
Names & synonyms
77966-40-6DTXSID70999159N-(2-Chloro-6-methylphenyl)-2-(cyclohexylamino)ethanimidic acid--hydrogen chloride (1/1)RefChem:1090987DTXCID001426134C 31156'-Chloro-2-(cyclohexylamino)-o-acetotoluidide, hydrochlorideo-ACETOTOLUIDIDE, 6'-CHLORO-2-(CYCLOHEXYLAMINO)-, HYDROCHLORIDE
Database identifiers
- CAS
77966-40-6- PubChem CID
- 53883
Properties
Computed structural properties
- Topological polar surface area
- 45.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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