Cas no 86153-25-5 (7-Bromo-1H-indole-3-carboxylic acid)

7-Bromo-1H-indole-3-carboxylic acid is a brominated indole derivative widely used as a versatile intermediate in organic synthesis and pharmaceutical research. Its key structural features include a carboxylic acid group at the 3-position and a bromine substituent at the 7-position, enabling selective functionalization for the development of complex heterocyclic compounds. This compound is particularly valuable in medicinal chemistry for the synthesis of biologically active molecules, including kinase inhibitors and other therapeutic agents. Its high purity and well-defined reactivity make it a reliable building block for cross-coupling reactions, amide formations, and other transformations. Suitable for research applications requiring precise molecular modifications.
7-Bromo-1H-indole-3-carboxylic acid structure
86153-25-5 structure
Product Name:7-Bromo-1H-indole-3-carboxylic acid
CAS No:86153-25-5
MF:C9H6BrNO2
MW:240.053441524506
MDL:MFCD07369966
CID:706797
PubChem ID:24820463
Update Time:2025-06-26

7-Bromo-1H-indole-3-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 7-Bromo-1H-indole-3-carboxylic acid
    • 1H-INDOLE-3-CARBOXYLIC ACID,7-BROMO-
    • 7-bromoindole-3-carboxylic acid
    • 1H-Indole-3-carboxylic acid, 7-bromo-
    • 1H-Indole-3-carboxylicacid, 7-bromo-
    • 7-Bromo-1H-indole-3-carboxylicacid
    • RMWZYIREGHRJOQ-UHFFFAOYSA-N
    • VI30348
    • SB13942
    • SY023120
    • ST2419024
    • AB0007610
    • W8851
    • AMY24377
    • CS-0130495
    • AKOS015898365
    • 86153-25-5
    • FT-0602629
    • MFCD07369966
    • Z1143220556
    • AS-38022
    • EN300-253339
    • DTXSID50647520
    • AC-9215
    • J-519107
    • SCHEMBL3762044
    • 7-bromoindole-3-carboxylicacid
    • DTXCID60598271
    • DB-031736
    • MDL： MFCD07369966
    • Inchi： 1S/C9H6BrNO2/c10-7-3-1-2-5-6(9(12)13)4-11-8(5)7/h1-4,11H,(H,12,13)
    • InChI Key： RMWZYIREGHRJOQ-UHFFFAOYSA-N
    • SMILES： BrC1=CC=CC2C(C(=O)O)=CNC=21

Computed Properties

  • Exact Mass: 238.95800
  • Monoisotopic Mass: 238.958
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 222
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.7
  • Topological Polar Surface Area: 53.1

Experimental Properties

  • Color/Form: Pale-yellow to Yellow-brown Solid
  • Density: 1.838
  • Boiling Point: 470.9℃ at 760 mmHg
  • Flash Point: 238.6°C
  • Refractive Index: 1.749
  • PSA: 53.09000
  • LogP: 2.62860
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

7-Bromo-1H-indole-3-carboxylic acid Security Information

7-Bromo-1H-indole-3-carboxylic acid Customs Data

  • HS CODE：2933990090
  • Customs Data：

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

7-Bromo-1H-indole-3-carboxylic acid Pricemore >>

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