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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-

OC(=O)c1ccc(c(c1F)F)N Request for Quotation
Chemical Name: Benzoic acid, 4-amino-2,3-difluoro-
CAS Number: 194804-85-8
Product Number: AG007RFO(AGN-PC-0KKP28)
Synonyms:
MDL No:
Molecular Formula: C7H5F2NO2
Molecular Weight: 173.1169

Identification/Properties

Computed Properties
Molecular Weight:
173.119g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
173.029g/mol
Monoisotopic Mass:
173.029g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
188
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum

PNMR/4-Amino-23-difluorobenzoic_acid-194804-85-8-hnmr.pdf

Other Analytical Data

POTHER/4-Amino-23-difluorobenzoic_acid-194804-85-8-hplc.pdf

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Chemical Structure


In chemical synthesis, 4-Amino-2,3-difluorobenzoic acid plays a crucial role as a versatile building block. It serves as a key intermediate in the production of various pharmaceuticals, agrochemicals, and specialty chemicals. With its unique structure and functionality, this compound enables the synthesis of diverse molecular entities with desirable properties.4-Amino-2,3-difluorobenzoic acid serves as a valuable precursor in the preparation of fluorinated aromatic compounds, which are widely used in medicinal chemistry for drug development. Its presence in a molecule can enhance its biological activity, metabolic stability, and overall potency. This amino acid derivative also acts as a valuable starting material for the synthesis of herbicides, pesticides, and other crop protection agents.Additionally, the versatile nature of 4-Amino-2,3-difluorobenzoic acid allows for its utilization in the creation of specialty chemicals for various industrial applications. Its presence in the chemical synthesis process imparts unique properties to the final products, making it a valuable component in the development of advanced materials and functional molecules.