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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)-

1H-Indole-4-carboxylic acid, 7-chloro-

OC(=O)c1ccc(c2c1cc[nH]2)Cl Request for Quotation
Chemical Name: 1H-Indole-4-carboxylic acid, 7-chloro-
CAS Number: 588688-45-3
Product Number: AG00ELPP(AGN-PC-09SIV9)
Synonyms:
MDL No:
Molecular Formula: C9H6ClNO2
Molecular Weight: 195.6024

Identification/Properties

Computed Properties
Molecular Weight:
195.602g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
195.009g/mol
Monoisotopic Mass:
195.009g/mol
Topological Polar Surface Area:
53.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
222
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


7-Chloro-1H-indole-4-carboxylic acid is a versatile building block widely utilized in chemical synthesis. Its functionality as a substituted indole derivative enables its incorporation into various organic molecules and pharmaceutical compounds. In chemical synthesis, this compound serves as a key intermediate in the preparation of diverse indole-based products, including agrochemicals, pharmaceuticals, and materials with potential biological activities. Due to its unique structure and reactivity, 7-Chloro-1H-indole-4-carboxylic acid plays a crucial role in the construction of complex molecular scaffolds through strategic chemical transformations such as cross-coupling reactions, nucleophilic substitutions, and cyclization reactions. Its controlled manipulation allows chemists to access a broad range of functionalized derivatives with tailored properties and activities, making it an indispensable tool in the synthesis of novel compounds in both academic research and industrial applications.