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Home > Nitro Compounds > 1378588-29-4
1378588-29-4 | 6-Nitropyridine-3-carbonitrile
CAS No: 1378588-29-4 Catalog No: AG019GD1 MDL No:MFCD12025515
Product Description
Catalog Number:
AG019GD1
Chemical Name:
6-Nitropyridine-3-carbonitrile
CAS Number:
1378588-29-4
Molecular Formula:
C6H3N3O2
Molecular Weight:
149.1069
MDL Number:
MFCD12025515
IUPAC Name:
6-nitropyridine-3-carbonitrile
InChI:
InChI=1S/C6H3N3O2/c7-3-5-1-2-6(8-4-5)9(10)11/h1-2,4H
InChI Key:
VLRBGTPNHRUFTB-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(nc1)[N+](=O)[O-]
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.023g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
149.109g/mol
Monoisotopic Mass:
149.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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