2-Propenamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methyl-


Chemical Name: 2-Propenamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-2-methyl-
CAS Number: 90357-53-2
Product Number: AG00IG49(AGN-PC-0NGP2S)
Synonyms:
MDL No:
Molecular Formula: C12H9F3N2O
Molecular Weight: 254.2079

Identification/Properties


Computed Properties
Molecular Weight:
254.212g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
254.067g/mol
Monoisotopic Mass:
254.067g/mol
Topological Polar Surface Area:
52.9A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
394
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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