1. Home
  2. Benzoic acid, 2-fluoro-3-(trifluoromethyl)-, methyl ester

Contact Angene

Tel: +852 8191 6999

Email: sales@angenechemical.com

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-fluoro-3-(trifluoromethyl)-, methyl ester

COC(=O)c1cccc(c1F)C(F)(F)F Request for Quotation
Chemical Name: Benzoic acid, 2-fluoro-3-(trifluoromethyl)-, methyl ester
CAS Number: 178748-05-5
Product Number: AG0026AA(AGN-PC-022P6C)
Synonyms:
MDL No:
Molecular Formula: C9H6F4O2
Molecular Weight: 222.1364

Identification/Properties

Properties
MP:
113-116 °C(lit.)
BP:
258.333°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
222.139g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
222.03g/mol
Monoisotopic Mass:
222.03g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
239
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

Request for Quotation

Customer Feedback

Chemical Structure


Methyl 2-fluoro-3-(trifluoromethyl)benzoate is a valuable compound widely utilized in chemical synthesis as a versatile building block for the creation of various pharmaceuticals, agrochemicals, and advanced materials. This compound serves as a key intermediate in the production of diverse organic molecules due to its unique chemical properties.In organic synthesis, Methyl 2-fluoro-3-(trifluoromethyl)benzoate acts as a crucial starting material for the introduction of functional groups such as fluorine and trifluoromethyl onto target molecules. These substituents play a significant role in enhancing the biological activity, stability, and lipophilicity of the final products. Additionally, the presence of both fluoro and trifluoromethyl groups in the compound imparts desirable physicochemical properties that are beneficial for the development of novel compounds with improved performance characteristics.Moreover, the strategic incorporation of Methyl 2-fluoro-3-(trifluoromethyl)benzoate into synthetic pathways enables chemists to access a wide range of structurally diverse compounds with varying pharmacological or material properties. Its ability to serve as a versatile precursor for various transformations underscores its significance in the synthesis of complex molecules with high efficiency and functional versatility.Overall, Methyl 2-fluoro-3-(trifluoromethyl)benzoate plays a crucial role in the realm of chemical synthesis by enabling the construction of intricate organic frameworks and facilitating the discovery of novel compounds with promising applications across different sectors of the chemical industry.