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Home > Nitro Compounds > 89862-07-7
89862-07-7 | 2-Propenamide, 3-(6-methyl-5-nitro-2-pyridinyl)-N-phenyl-
CAS No: 89862-07-7 Catalog No: AG003X1T MDL No:
Product Description
Catalog Number:
AG003X1T
Chemical Name:
2-Propenamide, 3-(6-methyl-5-nitro-2-pyridinyl)-N-phenyl-
CAS Number:
89862-07-7
Molecular Formula:
C15H13N3O3
Molecular Weight:
283.2820
IUPAC Name:
3-(6-methyl-5-nitropyridin-2-yl)-N-phenylprop-2-enamide
InChI:
InChI=1S/C15H13N3O3/c1-11-14(18(20)21)9-7-13(16-11)8-10-15(19)17-12-5-3-2-4-6-12/h2-10H,1H3,(H,17,19)
InChI Key:
BJGMNRJOOWSXEE-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1)C=Cc1ccc(c(n1)C)[N+](=O)[O-]
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.096g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
283.287g/mol
Monoisotopic Mass:
283.096g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.4
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