Basic information
- CAS
77791-55-0- Standard SMILES
CCCC[NH2+]CC(=O)Nc1ccccc1Cl.[Cl-]- InChIKey
WXUBXPWWNAFOAC-UHFFFAOYSA-N- Molecular formula
- C12H18Cl2N2O
- Average molar mass
- 277.19 g/mol
- Monoisotopic mass
- 276.0796186
Names & identifiers
- Preferred name
- 2-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)
- IUPAC
- butyl-[2-(2-chloroanilino)-2-oxoethyl]azanium chloride
Names & synonyms
77791-55-0DTXSID209989902-(Butylamino)-N-(2-chlorophenyl)ethanimidic acid--hydrogen chloride (1/1)RefChem:1061507DTXCID201425968C 54132-(Butylamino)-2'-chloroacetanilide, hydrochlorideACETANILIDE, 2-(BUTYLAMINO)-2'-CHLORO-, HYDROCHLORIDE
Database identifiers
- CAS
77791-55-0- PubChem CID
- 53765
Properties
Computed structural properties
- Topological polar surface area
- 45.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 211
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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