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146774-74-5 | Benzamide, 4-methyl-N-[2-(2,2,2-trichloroacetyl)phenyl]-
CAS No: 146774-74-5 Catalog No: AG001EB5 MDL No:
Product Description
Catalog Number:
AG001EB5
Chemical Name:
Benzamide, 4-methyl-N-[2-(2,2,2-trichloroacetyl)phenyl]-
CAS Number:
146774-74-5
Molecular Formula:
C16H12Cl3NO2
Molecular Weight:
356.6310
IUPAC Name:
4-methyl-N-[2-(2,2,2-trichloroacetyl)phenyl]benzamide
InChI:
InChI=1S/C16H12Cl3NO2/c1-10-6-8-11(9-7-10)15(22)20-13-5-3-2-4-12(13)14(21)16(17,18)19/h2-9H,1H3,(H,20,22)
InChI Key:
HQSWIMNEPNCKSS-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)C(=O)Nc1ccccc1C(=O)C(Cl)(Cl)Cl
Properties
Complexity:
414
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.993g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
356.627g/mol
Monoisotopic Mass:
354.993g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
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