Home Nitriles 2-Pyridinecarbonitrile, 5-fluoro-1,6-dihydro-1-methyl-6-oxo-

2-Pyridinecarbonitrile, 5-fluoro-1,6-dihydro-1-methyl-6-oxo-

CAS No.:
1887015-55-5
Catalog Number:
AG00IM0U
Molecular Formula:
C7H5FN2O
Molecular Weight:
152.1258
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Product Description
Catalog Number:
AG00IM0U
Chemical Name:
2-Pyridinecarbonitrile, 5-fluoro-1,6-dihydro-1-methyl-6-oxo-
CAS Number:
1887015-55-5
Molecular Formula:
C7H5FN2O
Molecular Weight:
152.1258
MDL Number:
MFCD29126235
IUPAC Name:
5-fluoro-1-methyl-6-oxopyridine-2-carbonitrile
InChI:
InChI=1S/C7H5FN2O/c1-10-5(4-9)2-3-6(8)7(10)11/h2-3H,1H3
InChI Key:
VMUOXNQVBSAYQR-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(c(=O)n1C)F
Properties
Complexity:
308  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.039g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.128g/mol
Monoisotopic Mass:
152.039g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties