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138167-67-6 | 2-Propenamide, 2-methyl-N-(2,3,4,5,6-pentafluorophenyl)-
CAS No: 138167-67-6 Catalog No: AG001833 MDL No:
Product Description
Catalog Number:
AG001833
Chemical Name:
2-Propenamide, 2-methyl-N-(2,3,4,5,6-pentafluorophenyl)-
CAS Number:
138167-67-6
Molecular Formula:
C10H6F5NO
Molecular Weight:
251.1528
IUPAC Name:
2-methyl-N-(2,3,4,5,6-pentafluorophenyl)prop-2-enamide
InChI:
InChI=1S/C10H6F5NO/c1-3(2)10(17)16-9-7(14)5(12)4(11)6(13)8(9)15/h1H2,2H3,(H,16,17)
InChI Key:
AHERRLDFNRQRKQ-UHFFFAOYSA-N
SMILES:
O=C(C(=C)C)Nc1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.037g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
251.156g/mol
Monoisotopic Mass:
251.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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