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87883-20-3 | 3-Pyridinecarboxaldehyde, 5-nitro-
CAS No: 87883-20-3 Catalog No: AG008CFM MDL No:
Product Description
Catalog Number:
AG008CFM
Chemical Name:
3-Pyridinecarboxaldehyde, 5-nitro-
CAS Number:
87883-20-3
Molecular Formula:
C6H4N2O3
Molecular Weight:
152.1076
IUPAC Name:
5-nitropyridine-3-carbaldehyde
InChI:
InChI=1S/C6H4N2O3/c9-4-5-1-6(8(10)11)3-7-2-5/h1-4H
InChI Key:
UJOOPEFUADGBNG-UHFFFAOYSA-N
SMILES:
O=Cc1cncc(c1)[N+](=O)[O-]
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.022g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.109g/mol
Monoisotopic Mass:
152.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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