1. Home
  2. Benzoic acid, 3-cyano-5-fluoro-

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, 3-cyano-5-fluoro-

N#Cc1cc(F)cc(c1)C(=O)O Request for Quotation
Chemical Name: Benzoic acid, 3-cyano-5-fluoro-
CAS Number: 327056-74-6
Product Number: AG00I687(AGN-PC-0KKM5P)
Synonyms:
MDL No:
Molecular Formula: C8H4FNO2
Molecular Weight: 165.1213

Identification/Properties

Properties
MP:
172-173°C
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Stability:
Air Sensitive
Computed Properties
Molecular Weight:
165.123g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
165.023g/mol
Monoisotopic Mass:
165.023g/mol
Topological Polar Surface Area:
61.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
233
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
Precautionary Statements:
P262-P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

Request for Quotation

Customer Feedback

Chemical Structure


3-Cyano-5-fluorobenzoic acid is a versatile building block in chemical synthesis due to its unique properties and reactivity. This compound is commonly used as a key intermediate in the production of various pharmaceuticals, agrochemicals, and advanced materials. In organic synthesis, 3-Cyano-5-fluorobenzoic acid serves as a precursor for the synthesis of biologically active compounds, such as antiviral and anticancer agents. Its cyano and fluorine functional groups make it a valuable starting material for introducing specific chemical functionalities into a molecule during synthetic transformations. Additionally, the presence of the carboxylic acid group in 3-Cyano-5-fluorobenzoic acid allows for further derivatization through condensation reactions, esterification, or amidation, enabling the incorporation of this compound into more complex molecular structures with enhanced biological or physical properties.