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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, 2-chloro-3,6-difluoro-

Fc1ccc(c(c1Cl)C(=O)O)F Request for Quotation
Chemical Name: Benzoic acid, 2-chloro-3,6-difluoro-
CAS Number: 287172-74-1
Product Number: AG002W8M(AGN-PC-0KKVI4)
Synonyms:
MDL No:
Molecular Formula: C7H3ClF2O2
Molecular Weight: 192.5473

Identification/Properties

Properties
MP:
126-128 °C
BP:
266.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
192.546g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
191.979g/mol
Monoisotopic Mass:
191.979g/mol
Topological Polar Surface Area:
37.3A^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#:
-
Hazard Statements:
H302-H315-H320-H335
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


2-Chloro-3,6-difluorobenzoic acid is a versatile compound commonly used in chemical synthesis for the preparation of various organic molecules. This compound serves as a key building block in the production of pharmaceuticals, agrochemicals, and materials due to its unique chemical properties. In chemical synthesis, 2-Chloro-3,6-difluorobenzoic acid is often employed as a precursor in the formation of more complex structures through substitution or coupling reactions. Its halogen substituents enable selective transformations, allowing for the introduction of fluorine-containing groups into target molecules. Additionally, the presence of the carboxylic acid functional group in this compound offers opportunities for further derivatization, leading to the creation of diverse chemical structures with desired properties in various applications.