Cas no 219508-19-7 (3-Bromo-1H-indole-6-carboxylic acid)

3-Bromo-1H-indole-6-carboxylic acid structure
219508-19-7 structure
Product Name:3-Bromo-1H-indole-6-carboxylic acid
CAS No:219508-19-7
MF:C9H6BrNO2
MW:240.053441524506
MDL:MFCD11109855
CID:850793
PubChem ID:15543043
Update Time:2025-04-19

3-Bromo-1H-indole-6-carboxylic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Bromo-1H-indole-6-carboxylic acid
    • 3-Bromoindole-6-carboxylic Acid
    • 1H-Indole-6-carboxylic acid, 3-bromo-
    • 3-Bromoindole-6-carboxylicAcid
    • XZNVEIYDUGPMCS-UHFFFAOYSA-N
    • SB15318
    • TRA0011070
    • RP28406
    • FCH1402573
    • SY006248
    • AB1000724
    • AX8160316
    • AB0065478
    • V4411
    • 219508-19-7
    • MFCD11109855
    • DB-014606
    • J-511799
    • AS-31482
    • CS-0044446
    • DTXSID50573895
    • SCHEMBL3879941
    • AKOS015903442
    • MDL： MFCD11109855
    • Inchi： 1S/C9H6BrNO2/c10-7-4-11-8-3-5(9(12)13)1-2-6(7)8/h1-4,11H,(H,12,13)
    • InChI Key： XZNVEIYDUGPMCS-UHFFFAOYSA-N
    • SMILES： BrC1=CNC2C=C(C(=O)O)C=CC=21

Computed Properties

  • Exact Mass: 238.95800
  • Monoisotopic Mass: 238.95819g/mol
  • 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
  • Topological Polar Surface Area: 53.1
  • XLogP3: 2.3

Experimental Properties

  • Boiling Point: 470.9℃ at 760 mmHg
  • Flash Point: 238.6℃
  • PSA: 53.09000
  • LogP: 2.62860

3-Bromo-1H-indole-6-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%

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