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2,4-dichloro-N-[2-chloro-5-(trifluoromethyl)phenyl]benzamide

HCID 295121
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Basic information

CAS
326883-46-9
Standard SMILES
O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1ccc(Cl)cc1Cl
InChIKey
JNRSNMAGNZHXQP-UHFFFAOYSA-N
Molecular formula
C14H7Cl3F3NO
Average molar mass
368.6 g/mol
Monoisotopic mass
366.954531

Names & identifiers

Preferred name
2,4-dichloro-N-[2-chloro-5-(trifluoromethyl)phenyl]benzamide
IUPAC
2,4-dichloro-N-[2-chloro-5-(trifluoromethyl)phenyl]benzamide
English name
2,4-Dichloro-N-(2-chloro-5-trifluoromethyl-phenyl)-benzamide
Molecular formula
C14H7Cl3F3NO
Molecular weight
368.57

Names & synonyms

2,4-dichloro-N-[2-chloro-5-(trifluoromethyl)phenyl]benzamideNSC164277CBMicro_015315STK412591AKOS001598348NSC-164277BIM-0015243.P001ST50910867SR-01000412613SR-01000412613-1(2,4-dichlorophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]carboxamide2,4-DICHLORO-N-(2-CHLORO-5-TRIFLUOROMETHYL-PHENYL)-BENZAMIDE
Show more names
Benzamide, 2,4-dichloro-N-[2-chloro-5-(trifluoromethyl)phenyl]-

Database identifiers

CAS
326883-46-9
PubChem CID
295121
EC Number
168-258-8

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
29.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
407

Physicochemical properties

Boiling point
351.411 · 351.411±42.00 °C(Press: 760.00 Torr)(predicted)
Density
1.551 · 1.551±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
pka
10.649 · 10.649±0.70(predicted)

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