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Home > Nitro Compounds > 14080-32-1
14080-32-1 | Pyrimidine, 5-nitro-
CAS No: 14080-32-1 Catalog No: AG001CRT MDL No:MFCD09909680
Product Description
Catalog Number:
AG001CRT
Chemical Name:
Pyrimidine, 5-nitro-
CAS Number:
14080-32-1
Molecular Formula:
C4H3N3O2
Molecular Weight:
125.0855
MDL Number:
MFCD09909680
IUPAC Name:
5-nitropyrimidine
InChI:
InChI=1S/C4H3N3O2/c8-7(9)4-1-5-3-6-2-4/h1-3H
InChI Key:
NOYDQGFVFOQSAJ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cncnc1
Properties
Complexity:
105
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.023g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
125.087g/mol
Monoisotopic Mass:
125.023g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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