Basic information
- CAS
77791-66-3- Standard SMILES
CC[NH+](CC)CC(=O)Nc1c(Cl)cc(Cl)cc1Cl.[Cl-]- InChIKey
UNCKXMXKRDFTGJ-UHFFFAOYSA-N- Molecular formula
- C12H16Cl4N2O
- Average molar mass
- 346.1 g/mol
- Monoisotopic mass
- 344.001674
Names & identifiers
- Preferred name
- 2-(Diethylamino)-N-(2,4,6-trichlorophenyl)ethanimidic acid--hydrogen chloride (1/1)
- IUPAC
- diethyl-[2-oxo-2-(2,4,6-trichloroanilino)ethyl]azanium chloride
Names & synonyms
77791-66-3DTXSID009989932-(Diethylamino)-N-(2,4,6-trichlorophenyl)ethanimidic acid--hydrogen chloride (1/1)RefChem:1061582DTXCID901425971V 3402-(Diethylamino)-2',4',6'-trichloroacetanilide, hydrochlorideACETANILIDE, 2-(DIETHYLAMINO)-2',4',6'-TRICHLORO-, HYDROCHLORIDE
Database identifiers
- CAS
77791-66-3- PubChem CID
- 53777
Properties
Computed structural properties
- Topological polar surface area
- 33.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 262
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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