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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)-

Benzoic acid, 4-amino-2,3-difluoro-5-nitro-, methyl ester

COC(=O)c1cc([N+](=O)[O-])c(c(c1F)F)N Request for Quotation
Chemical Name: Benzoic acid, 4-amino-2,3-difluoro-5-nitro-, methyl ester
CAS Number: 284030-58-6
Product Number: AG007KOG(AGN-PC-0KKNGC)
Synonyms:
MDL No:
Molecular Formula: C8H6F2N2O4
Molecular Weight: 232.1410

Identification/Properties

Computed Properties
Molecular Weight:
232.143g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
2
Exact Mass:
232.03g/mol
Monoisotopic Mass:
232.03g/mol
Topological Polar Surface Area:
98.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
296
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


Methyl 4-amino-2,3-difluoro-5-nitrobenzoate is a versatile compound commonly utilized in chemical synthesis for its unique properties and reactivity. With its well-defined structure and predictable behavior, this compound is widely employed as a key intermediate in the production of various pharmaceuticals, agrochemicals, and fine chemicals. Its strategic placement of functional groups enables precise control over subsequent reactions, making it an essential building block in the synthesis of complex organic molecules. In pharmaceutical research, Methyl 4-amino-2,3-difluoro-5-nitrobenzoate serves as a crucial starting material for the development of new drug candidates, offering chemists a reliable pathway to access diverse molecular scaffolds with potential therapeutic applications. In agrochemical synthesis, this compound plays a vital role in the creation of novel crop protection agents and pesticides, where its specific functional groups can be tailored to confer desired biological activity. Additionally, in the realm of fine chemicals production, Methyl 4-amino-2,3-difluoro-5-nitrobenzoate serves as a valuable tool for crafting specialty materials and compounds with enhanced properties. Overall, this compound's utility in chemical synthesis stems from its versatility, enabling chemists to harness its intrinsic reactivity to drive complex molecular transformations and deliver innovative solutions across various industries.