Cas no 885519-03-9 (4-Bromo-6-chloro-1H-indazole)

4-Bromo-6-chloro-1H-indazole structure
4-Bromo-6-chloro-1H-indazole structure
Product Name:4-Bromo-6-chloro-1H-indazole
CAS No:885519-03-9
MF:C7H4BrClN2
MW:231.477059364319
MDL:MFCD07781352
CID:711927
PubChem ID:24728100
Update Time:2024-12-09

4-Bromo-6-chloro-1H-indazole Chemical and Physical Properties

Names and Identifiers

    • 4-Bromo-6-chloro-1H-indazole
    • 1H-Indazole, 4-bromo-6-chloro-
    • 1H-Indazole,4-bromo-6-chloro
    • RW3751
    • 4-bromo-6-chloro-indazole
    • 1H-Indazole,4-bromo-6-chloro-
    • KCDKINCUTSIQAF-UHFFFAOYSA-N
    • BCP23739
    • TRA0020717
    • MB04830
    • FCH1385645
    • SY004065
    • ST2411219
    • AB1000027
    • AX8095133
    • AB0032780
    • X6192
    • 4-Bromo-6-chloro-1H-indazole (ACI)
    • DB-218798
    • SCHEMBL25103760
    • J-514774
    • AC-4436
    • AS-19267
    • SCHEMBL2003535
    • CS-D1585
    • 885519-03-9
    • AKOS015904067
    • MFCD07781352
    • DTXSID60646165
    • MDL: MFCD07781352
    • Inchi: 1S/C7H4BrClN2/c8-6-1-4(9)2-7-5(6)3-10-11-7/h1-3H,(H,10,11)
    • InChI Key: KCDKINCUTSIQAF-UHFFFAOYSA-N
    • SMILES: ClC1C=C2C(C=NN2)=C(Br)C=1

Computed Properties

  • Exact Mass: 229.92500
  • Monoisotopic Mass: 229.925
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 0
  • Complexity: 155
  • 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
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: 2.9
  • Topological Polar Surface Area: 28.7

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.878
  • Melting Point: No data available
  • Boiling Point: 364.1±22.0 °C at 760 mmHg
  • Flash Point: 174℃
  • Refractive Index: 1.73
  • PSA: 28.68000
  • LogP: 2.97880
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

4-Bromo-6-chloro-1H-indazole 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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4-Bromo-6-chloro-1H-indazole Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Hydrazine hydrate (1:1) Solvents: Water ;  rt
Reference
Synthetic of pyrrole-2,5-dicarboxylic acid and its esters
Li, Wei-jie, Huaxue Shiji, 2013, 35(9), 859-861

Production Method 2

Reaction Conditions
1.1 Reagents: Hydrazine hydrate (1:1) Solvents: 1,4-Dioxane ;  5 h, rt → 80 °C
Reference
Synthesis of 4-bromo-6-chloro-1 H-indazole
Weng, Yun-wo; Wang, Tao; Lei, Ming, Huaxue Shiji, 2013, 35(9), 857-858

4-Bromo-6-chloro-1H-indazole Raw materials

4-Bromo-6-chloro-1H-indazole Preparation Products

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