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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)-

Benzenesulfonamide, 4-(trifluoromethoxy)-

FC(Oc1ccc(cc1)S(=O)(=O)N)(F)F Request for Quotation
Chemical Name: Benzenesulfonamide, 4-(trifluoromethoxy)-
CAS Number: 1513-45-7
Product Number: AG001N8Y(AGN-PC-0KKY2L)
Synonyms:
MDL No:
Molecular Formula: C7H6F3NO3S
Molecular Weight: 241.1876

Identification/Properties

Properties
MP:
146-148 °C(lit.)
BP:
301.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
241.184g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
2
Exact Mass:
241.002g/mol
Monoisotopic Mass:
241.002g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
300
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:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-(Trifluoromethoxy)benzenesulfonamide is a versatile compound widely utilized in chemical synthesis as an important building block for creating various pharmaceuticals, agrochemicals, and advanced materials. Its unique structure, featuring a trifluoromethoxy group attached to a benzenesulfonamide moiety, imparts valuable properties that enhance the efficacy and versatility of the synthesized products. In chemical synthesis, this compound serves as a key intermediate in the development of diverse organic molecules due to its ability to participate in a variety of reactions, including nucleophilic substitutions, cross-coupling reactions, and transition metal-catalyzed transformations. By incorporating 4-(Trifluoromethoxy)benzenesulfonamide into synthetic routes, chemists can efficiently introduce the trifluoromethoxy group into target molecules, thereby modulating the physicochemical properties and biological activities of the final compounds. This compound's utility extends to medicinal chemistry, where it plays a crucial role in designing novel drug candidates with enhanced pharmacokinetic profiles and biological functions. Additionally, its application in material science enables the creation of functional materials with tailored properties for diverse industrial applications. Overall, 4-(Trifluoromethoxy)benzenesulfonamide stands as a valuable tool in the arsenal of synthetic chemists, facilitating the development of innovative compounds with potential applications in pharmaceuticals, agriculture, and materials science.