6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carbonitrile


Chemical Name: 6-(4-fluorophenyl)-2-oxo-1H-pyridine-3-carbonitrile
CAS Number: 31755-80-3
Product Number: AG00C881(AGN-PC-0KKQQA)
Synonyms:
MDL No:
Molecular Formula: C12H7FN2O
Molecular Weight: 214.1952

Identification/Properties


Properties
MP:
>300℃
Form:
Solid
Computed Properties
Molecular Weight:
214.199g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
214.054g/mol
Monoisotopic Mass:
214.054g/mol
Topological Polar Surface Area:
52.9A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
408
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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