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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)-

2-Benzofurancarboxylic acid, 7-chloro-

OC(=O)c1cc2c(o1)c(Cl)ccc2 Request for Quotation
Chemical Name: 2-Benzofurancarboxylic acid, 7-chloro-
CAS Number: 63558-84-9
Product Number: AG00IB8G(AGN-PC-01WL1Z)
Synonyms:
MDL No:
Molecular Formula: C9H5ClO3
Molecular Weight: 196.5872

Identification/Properties

Computed Properties
Molecular Weight:
196.586g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
195.993g/mol
Monoisotopic Mass:
195.993g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
219
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


7-Chlorobenzofuran-2-carboxylic acid is an essential building block in chemical synthesis, primarily used as a key intermediate in the production of various pharmaceuticals and agrochemicals. Its versatility lies in its ability to undergo multiple functional group transformations, such as amidation, esterification, and oxidation reactions, making it a valuable tool in the creation of complex organic molecules. In medicinal chemistry, this compound serves as a crucial precursor for the synthesis of potential drug candidates, offering opportunities for the modification of its structure to enhance biological activity or improve pharmacokinetic properties. Additionally, in the field of agrochemicals, 7-Chlorobenzofuran-2-carboxylic acid can be utilized to synthesize insecticides, fungicides, and herbicides, contributing to the development of new and effective crop protection products. Its role in chemical synthesis underscores its significance in driving innovation and discovery across various sectors of the chemical industry.