1H-Pyrazole-5-carboxylic acid, 1-methyl-4-nitro-


Chemical Name: 1H-Pyrazole-5-carboxylic acid, 1-methyl-4-nitro-
CAS Number: 92534-69-5
Product Number: AG0064HT(AGN-PC-0JTG09)
Synonyms:
MDL No:
Molecular Formula: C5H5N3O4
Molecular Weight: 171.1109

Identification/Properties


Properties
MP:
160-161°C
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
171.112g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
171.028g/mol
Monoisotopic Mass:
171.028g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
213
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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