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N-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-2,5-bis(2,2,2-trifluoroethoxy)benzamide

HCID 178534580
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Basic information

CAS
338404-74-3
Standard SMILES
O=C(NCCNC(=O)C(Cl)(Cl)Cl)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F
InChIKey
XOBMOUJVSOFRSL-UHFFFAOYSA-N
Molecular formula
C15H13Cl3F6N2O4
Average molar mass
505.6 g/mol
Monoisotopic mass
503.984509

Names & identifiers

Preferred name
N-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-2,5-bis(2,2,2-trifluoroethoxy)benzamide
IUPAC
N-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-2,5-bis(2,2,2-trifluoroethoxy)benzamide
English name
N-(2-[(2,2,2-TRICHLOROACETYL)AMINO]ETHYL)-2,5-BIS(2,2,2-TRIFLUOROETHOXY)BENZENECARBOXAMIDE
Molecular formula
C15H13Cl3F6N2O4
Molecular weight
505.62

Names & synonyms

338404-74-3N-(2-{[2,5-bis(2,2,2-trifluoroethoxy)phenyl]formamido}ethyl)-2,2,2-trichloroacetamideN-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-2,5-bis(2,2,2-trifluoroethoxy)benzamideN-{2-[(2,2,2-trichloroacetyl)amino]ethyl}-2,5-bis(2,2,2-trifluoroethoxy)benzenecarboxamideAKOS0050874473E-355SN-(2-(2,2,2-trichloroacetamido)ethyl)-2,5-bis(2,2,2-trifluoroethoxy)benzamideBenzamide, N-[2-[(2,2,2-trichloroacetyl)amino]ethyl]-2,5-bis(2,2,2-trifluoroethoxy)-N-(2-[(2,2,2-TRICHLOROACETYL)AMINO]ETHYL)-2,5-BIS(2,2,2-TRIFLUOROETHOXY)BENZENECARBOXAMIDE

Database identifiers

CAS
338404-74-3
PubChem CID
4417378

Properties

Computed structural propertiesFilling in

XLogP
4.5
Topological polar surface area
76.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
10
Rotatable bonds
8
Heavy atoms
30
Formal charge
0
Complexity
586

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