200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 19872-96-9
19872-96-9 | 4(1H)-Pyridinone, 3,5-dinitro-
CAS No: 19872-96-9 Catalog No: AG002BP7 MDL No:MFCD00222297
Product Description
Catalog Number:
AG002BP7
Chemical Name:
4(1H)-Pyridinone, 3,5-dinitro-
CAS Number:
19872-96-9
Molecular Formula:
C5H3N3O5
Molecular Weight:
185.0944
MDL Number:
MFCD00222297
IUPAC Name:
3,5-dinitro-1H-pyridin-4-one
InChI:
InChI=1S/C5H3N3O5/c9-5-3(7(10)11)1-6-2-4(5)8(12)13/h1-2H,(H,6,9)
InChI Key:
PUHTYORYOUQZEB-UHFFFAOYSA-N
SMILES:
O=c1c(c[nH]cc1[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.007g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.095g/mol
Monoisotopic Mass:
185.007g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
121A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| catena-Poly[[[tetraaqua(3,5-dinitro-4-oxidopyridine N-oxide-κO)neodymium(III)]-μ-oxalato-κO,O:O,O] tetrahydrate]. | Acta crystallographica. Section E, Structure reports online 20101101 |
| 3,5-Dinitro-pyridin-4(1H)-one monohydrate. | Acta crystallographica. Section E, Structure reports online 20080901 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.