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366016-68-4 | (2E)-3-(2,4-Difluorophenyl)prop-2-enamide
CAS No: 366016-68-4 Catalog No: AG01EVPT MDL No:
Product Description
Catalog Number:
AG01EVPT
Chemical Name:
(2E)-3-(2,4-Difluorophenyl)prop-2-enamide
CAS Number:
366016-68-4
Molecular Formula:
C9H7F2NO
Molecular Weight:
183.1548
IUPAC Name:
(E)-3-(2,4-difluorophenyl)prop-2-enamide
InChI:
InChI=1S/C9H7F2NO/c10-7-3-1-6(8(11)5-7)2-4-9(12)13/h1-5H,(H2,12,13)/b4-2+
InChI Key:
NXKGMKYVIPCNBR-DUXPYHPUSA-N
SMILES:
NC(=O)/C=C/c1ccc(cc1F)F
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
183.05g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.158g/mol
Monoisotopic Mass:
183.05g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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