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Carbanilic acid, 2,4,6-trichloro-, 2-(diethylamino)ethyl ester, hydrochloride

HCID 30040
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Basic information

CAS
20228-99-3
Standard SMILES
CC[NH+](CC)CCOC(=O)Nc1c(Cl)cc(Cl)cc1Cl.[Cl-]
InChIKey
KNMQEXUIGSINFV-UHFFFAOYSA-N
Molecular formula
C13H18Cl4N2O2
Average molar mass
376.1 g/mol
Monoisotopic mass
374.012239

Names & identifiers

Preferred name
Carbanilic acid, 2,4,6-trichloro-, 2-(diethylamino)ethyl ester, hydrochloride
IUPAC
diethyl-[2-[(2,4,6-trichlorophenyl)carbamoyloxy]ethyl]azanium chloride

Names & synonyms

20228-99-3CARBANILIC ACID, 2,4,6-TRICHLORO-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDERefChem:10810332,4,6-Trichlorocarbanilic acid 2-(diethylamino)ethyl ester hydrochlorideK 489

Database identifiers

CAS
20228-99-3
PubChem CID
30040

Properties

Computed structural properties

Topological polar surface area
42.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
7
Heavy atoms
21
Formal charge
0
Complexity
291

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