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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

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

[O-][N+](=O)c1cnn(c1C(=O)O)C Request for Quotation
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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Chemical Structure


1-Methyl-4-nitro-1H-pyrazole-5-carboxylic acid is a versatile compound commonly employed in chemical synthesis as a key building block. Its unique chemical structure allows for a wide range of reactions and transformations, making it valuable in the production of various chemical compounds. This compound can be utilized as a precursor in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals due to its ability to participate in various substitution and addition reactions. Additionally, 1-Methyl-4-nitro-1H-pyrazole-5-carboxylic acid can serve as a starting material for the preparation of complex molecules with diverse functionalities, enhancing its utility in the field of organic chemistry. Its role in chemical synthesis extends to the creation of novel materials and compounds with potential applications in industries such as pharmaceuticals, materials science, and biochemistry. By leveraging the unique reactivity and structural features of 1-Methyl-4-nitro-1H-pyrazole-5-carboxylic acid, chemists can explore innovative synthetic routes and discover new compounds with promising properties and functions.