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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)-

4-(2,1,3-benzothiadiazol-5-ylmethoxy)benzoic acid

OC(=O)c1ccc(cc1)OCc1ccc2c(c1)nsn2 Request for Quotation
Chemical Name: 4-(2,1,3-benzothiadiazol-5-ylmethoxy)benzoic acid
CAS Number: 874834-22-7
Product Number: AG00IEMX(AGN-PC-01XG4X)
Synonyms:
MDL No:
Molecular Formula: C14H10N2O3S
Molecular Weight: 286.3058

Identification/Properties

Computed Properties
Molecular Weight:
286.305g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
286.041g/mol
Monoisotopic Mass:
286.041g/mol
Topological Polar Surface Area:
101A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
347
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-(Benzo[c][1,2,5]thiadiazol-5-ylmethoxy)benzoic acid is a versatile chemical compound widely used in chemical synthesis. Its unique structure containing a benzo[c][1,2,5]thiadiazole moiety offers several valuable applications in organic chemistry.In chemical synthesis, 4-(Benzo[c][1,2,5]thiadiazol-5-ylmethoxy)benzoic acid serves as a key building block for the construction of various functional molecules. Due to the presence of the benzo[c][1,2,5]thiadiazole ring, this compound can participate in a range of organic reactions, including substitution, oxidation, and coupling reactions. Its benzene carboxylic acid group further enhances its reactivity and compatibility in synthetic pathways.This compound finds particular utility in the design and synthesis of pharmaceuticals, agrochemicals, and materials. By incorporating 4-(Benzo[c][1,2,5]thiadiazol-5-ylmethoxy)benzoic acid into molecular frameworks, chemists can introduce specific functionalities and properties into target compounds, ultimately influencing their biological, chemical, or physical characteristics.Additionally, the presence of the benzo[c][1,2,5]thiadiazole moiety imparts certain photochemical and electronic properties to the molecules it is part of, making this compound valuable in the development of advanced materials such as organic electronic devices and luminescent materials.Overall, the unique structure and reactivity of 4-(Benzo[c][1,2,5]thiadiazol-5-ylmethoxy)benzoic acid make it a valuable tool in chemical synthesis, enabling the creation of diverse and tailored compounds for various applications in the fields of pharmaceuticals, agrochemicals, and materials science.