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Home > Fluorides > 115093-99-7
115093-99-7 | 2-Propenamide, 3-[4-(trifluoromethyl)phenyl]-, (2E)-
CAS No: 115093-99-7 Catalog No: AG000FW6 MDL No:
Product Description
Catalog Number:
AG000FW6
Chemical Name:
2-Propenamide, 3-[4-(trifluoromethyl)phenyl]-, (2E)-
CAS Number:
115093-99-7
Molecular Formula:
C10H8F3NO
Molecular Weight:
215.1718
IUPAC Name:
(E)-3-[4-(trifluoromethyl)phenyl]prop-2-enamide
InChI:
InChI=1S/C10H8F3NO/c11-10(12,13)8-4-1-7(2-5-8)3-6-9(14)15/h1-6H,(H2,14,15)/b6-3+
InChI Key:
BPRFEFAHXYCKRO-ZZXKWVIFSA-N
SMILES:
NC(=O)/C=C/c1ccc(cc1)C(F)(F)F
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
215.056g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
215.175g/mol
Monoisotopic Mass:
215.056g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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