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Home > Pyridines > 500578-21-2
500578-21-2 | 3-Pyridinecarbonitrile,5-ethyl-1,2-dihydro-2-oxo-(9CI)
CAS No: 500578-21-2 Catalog No: AG00E7N5 MDL No:
Product Description
Catalog Number:
AG00E7N5
Chemical Name:
3-Pyridinecarbonitrile,5-ethyl-1,2-dihydro-2-oxo-(9CI)
CAS Number:
500578-21-2
IUPAC Name:
5-ethyl-2-oxo-1H-pyridine-3-carbonitrile
InChI:
InChI=1S/C8H8N2O/c1-2-6-3-7(4-9)8(11)10-5-6/h3,5H,2H2,1H3,(H,10,11)
InChI Key:
HXGXLPGGAVKYBY-UHFFFAOYSA-N
NSC Number:
135822
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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