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108338-19-8 | 4-Nitropicolinaldehyde
CAS No: 108338-19-8 Catalog No: AG007D2B MDL No:MFCD07374896
Product Description
Catalog Number:
AG007D2B
Chemical Name:
4-Nitropicolinaldehyde
CAS Number:
108338-19-8
Molecular Formula:
C6H4N2O3
Molecular Weight:
152.1076
MDL Number:
MFCD07374896
IUPAC Name:
4-nitropyridine-2-carbaldehyde
InChI:
InChI=1S/C6H4N2O3/c9-4-5-3-6(8(10)11)1-2-7-5/h1-4H
InChI Key:
XWFNGAKFHUOJCQ-UHFFFAOYSA-N
SMILES:
O=Cc1nccc(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:
0.5
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