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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-Imidazole-5-carboxylic acid, 1-methyl-4-nitro-

[O-][N+](=O)c1ncn(c1C(=O)O)C Request for Quotation
Chemical Name: 1H-Imidazole-5-carboxylic acid, 1-methyl-4-nitro-
CAS Number: 54828-05-6
Product Number: AG00DDIM(AGN-PC-0JOIJ1)
Synonyms:
MDL No:
Molecular Formula: C5H5N3O4
Molecular Weight: 171.1109

Identification/Properties

Properties
MP:
153-154°C
Storage:
-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
171.112g/mol
XLogP3:
0
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-imidazole-5-carboxylic Acid is a versatile compound widely used in chemical synthesis for its unique properties and reactivity. In organic synthesis, this specific compound serves as a key building block for creating various pharmaceuticals, agrochemicals, and advanced materials. Its nitro and carboxylic acid functional groups make it a valuable intermediate for introducing specific functionalities or structural motifs into target molecules. Additionally, its imidazole ring provides opportunities for creating heterocyclic systems, which are commonly found in biologically active compounds. Due to its potent chemical reactivity and flexibility in molecular design, 1-Methyl-4-nitro-1H-imidazole-5-carboxylic Acid plays a crucial role in the development of new synthetic routes and the production of complex molecules with tailored properties.