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89153-98-0 | Methanone, (3-fluorophenyl)[2-[(3-nitro-2-pyridinyl)amino]phenyl]-
CAS No: 89153-98-0 Catalog No: AG003WZ0 MDL No:
Product Description
Catalog Number:
AG003WZ0
Chemical Name:
Methanone, (3-fluorophenyl)[2-[(3-nitro-2-pyridinyl)amino]phenyl]-
CAS Number:
89153-98-0
Molecular Formula:
C18H12FN3O3
Molecular Weight:
337.3046
IUPAC Name:
(3-fluorophenyl)-[2-[(3-nitropyridin-2-yl)amino]phenyl]methanone
InChI:
InChI=1S/C18H12FN3O3/c19-13-6-3-5-12(11-13)17(23)14-7-1-2-8-15(14)21-18-16(22(24)25)9-4-10-20-18/h1-11H,(H,20,21)
InChI Key:
IJIFMPITVCRRFU-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=O)c1ccccc1Nc1ncccc1[N+](=O)[O-]
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.086g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
337.31g/mol
Monoisotopic Mass:
337.086g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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