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Home > Pyridines > 1020719-32-7
1020719-32-7 | 3-Pyridine-2,4,5,6-d4-carbonitrile
CAS No: 1020719-32-7 Catalog No: AG0006JM MDL No:
Product Description
Catalog Number:
AG0006JM
Chemical Name:
3-Pyridine-2,4,5,6-d4-carbonitrile
CAS Number:
1020719-32-7
Molecular Formula:
C6D4N2
Molecular Weight:
108.1340
IUPAC Name:
2,4,5,6-tetradeuteriopyridine-3-carbonitrile
InChI:
InChI=1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H/i1D,2D,3D,5D
InChI Key:
GZPHSAQLYPIAIN-RZIJKAHPSA-N
SMILES:
N#Cc1c([2H])nc(c(c1[2H])[2H])[2H]
Properties
Complexity:
111
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.063g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
4
Molecular Weight:
108.136g/mol
Monoisotopic Mass:
108.063g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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