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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)-

2H-Benzimidazol-2-one, 1,3-dihydro-5-nitro-

[O-][N+](=O)c1ccc2c(c1)[nH]c(=O)[nH]2 Request for Quotation
Chemical Name: 2H-Benzimidazol-2-one, 1,3-dihydro-5-nitro-
CAS Number: 93-84-5
Product Number: AG003MWR(AGN-PC-0KZ74A)
Synonyms:
MDL No:
Molecular Formula: C7H5N3O3
Molecular Weight: 179.1329

Identification/Properties

Properties
MP:
>300 °C(lit.);
BP:
203 °C at 760 mmHg
Storage:
Light sensitive;Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
179.135g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
179.033g/mol
Monoisotopic Mass:
179.033g/mol
Topological Polar Surface Area:
87A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
250
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

GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


1,3-Dihydro-5-nitro-2H-benzimidazol-2-one is a versatile compound that finds significant application in chemical synthesis, particularly in the pharmaceutical and agrochemical industries. Known for its unique structure and reactivity, this molecule serves as a valuable building block in the creation of various advanced materials and complex organic compounds.In chemical synthesis, 1,3-Dihydro-5-nitro-2H-benzimidazol-2-one acts as a key intermediate in the preparation of a wide range of biologically active molecules. Its nitro group can undergo various chemical transformations, such as reduction or substitution reactions, to introduce diverse functional groups into the final product. This versatility makes it a valuable tool for medicinal chemists and researchers working on the development of new drugs and agricultural chemicals.Furthermore, the presence of a benzimidazole ring in the structure of 1,3-Dihydro-5-nitro-2H-benzimidazol-2-one imparts specific properties to the molecules synthesized from it. Benzimidazole derivatives are known for their pharmacological activities, including antimicrobial, antiviral, and anticancer properties. By incorporating this core structure into the design of novel compounds, researchers can explore new avenues in drug discovery and crop protection.Overall, the application of 1,3-Dihydro-5-nitro-2H-benzimidazol-2-one in chemical synthesis underscores its importance as a strategic building block for the creation of diverse and functionally rich molecules with potential applications in various fields of science and technology.