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Home > Fluorides > 878555-48-7
878555-48-7 | Pyridine, 2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-nitro-
CAS No: 878555-48-7 Catalog No: AG004JFA MDL No:
Product Description
Catalog Number:
AG004JFA
Chemical Name:
Pyridine, 2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-nitro-
CAS Number:
878555-48-7
Molecular Formula:
C12H6F4N2O2
Molecular Weight:
286.1819
IUPAC Name:
2-[2-fluoro-5-(trifluoromethyl)phenyl]-4-nitropyridine
InChI:
InChI=1S/C12H6F4N2O2/c13-10-2-1-7(12(14,15)16)5-9(10)11-6-8(18(19)20)3-4-17-11/h1-6H
InChI Key:
VBAACOPSOODRBM-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1c1nccc(c1)[N+](=O)[O-])C(F)(F)F
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
286.037g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
286.186g/mol
Monoisotopic Mass:
286.037g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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