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821004-83-5 | 2-Propenamide, N-(4-chlorophenyl)-3-(3,4-difluorophenyl)-
CAS No: 821004-83-5 Catalog No: AG0051T1 MDL No:
Product Description
Catalog Number:
AG0051T1
Chemical Name:
2-Propenamide, N-(4-chlorophenyl)-3-(3,4-difluorophenyl)-
CAS Number:
821004-83-5
Molecular Formula:
C15H10ClF2NO
Molecular Weight:
293.6958
IUPAC Name:
N-(4-chlorophenyl)-3-(3,4-difluorophenyl)prop-2-enamide
InChI:
InChI=1S/C15H10ClF2NO/c16-11-3-5-12(6-4-11)19-15(20)8-2-10-1-7-13(17)14(18)9-10/h1-9H,(H,19,20)
InChI Key:
KTCCZVGIKPYUAT-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccc(cc1)Cl)C=Cc1ccc(c(c1)F)F
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.042g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
293.698g/mol
Monoisotopic Mass:
293.042g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4
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