Cas no 903875-64-9 (5-Bromo-2-fluoro-3-methylbenzaldehyde)

5-Bromo-2-fluoro-3-methylbenzaldehyde structure
903875-64-9 structure
Product Name:5-Bromo-2-fluoro-3-methylbenzaldehyde
CAS No:903875-64-9
MF:C8H6BrFO
MW:217.035045146942
MDL:MFCD11110261
CID:1037426
PubChem ID:53216894
Update Time:2024-12-09

5-Bromo-2-fluoro-3-methylbenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 5-Bromo-2-fluoro-3-methylbenzaldehyde
    • Benzaldehyde, 5-bromo-2-fluoro-3-methyl-
    • JKHVNWUVFDFSAZ-UHFFFAOYSA-N
    • FCH1402656
    • 5-Bromo-2-fluoro-3-methyl-benzaldehyde
    • AX8210754
    • Z1057
    • ST24044429
    • F10173
    • 5-Bromo-2-fluoro-3-methylbenzaldehyde, AldrichCPR
    • 5-Bromo-2-fluoro-3-methylbenzaldehyde (ACI)
    • DTXSID60682023
    • AKOS015834361
    • CS-0153724
    • 903875-64-9
    • MFCD11110261
    • SCHEMBL1144801
    • SY253167
    • FS-5002
    • MDL: MFCD11110261
    • Inchi: 1S/C8H6BrFO/c1-5-2-7(9)3-6(4-11)8(5)10/h2-4H,1H3
    • InChI Key: JKHVNWUVFDFSAZ-UHFFFAOYSA-N
    • SMILES: O=CC1C(F)=C(C)C=C(Br)C=1

Computed Properties

  • Exact Mass: 215.95900
  • Monoisotopic Mass: 215.959
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 151
  • 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: 17.1
  • XLogP3: 2.5

Experimental Properties

  • PSA: 17.07000
  • LogP: 2.70910

5-Bromo-2-fluoro-3-methylbenzaldehyde Customs Data

  • HS CODE:2913000090
  • Customs Data:

    China Customs Code:

    2913000090

    Overview:

    2913000090 Item2912Other derivatives of the listed products [refer to halogenation,sulfonation,Nitrosative or nitrosative derivatives]. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS: 2913000090 halogenated, sulphonated, nitrated or nitrosated derivatives of products of heading 2912 Educational tariff:17.0% Tax rebate rate:9.0% Regulatory conditions:none Most favored nation tariff:5.5% General tariff:30.0%

5-Bromo-2-fluoro-3-methylbenzaldehyde Pricemore >>

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5-Bromo-2-fluoro-3-methylbenzaldehyde Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Lithium diisopropylamide Solvents: Tetrahydrofuran ;  -78 °C
1.2 -
Reference
Fragment-based discovery of JAK-2 inhibitors
Antonysamy, Stephen; Hirst, Gavin; Park, Frances; Sprengeler, Paul; Stappenbeck, Frank; et al, Bioorganic & Medicinal Chemistry Letters, 2009, 19(1), 279-282

5-Bromo-2-fluoro-3-methylbenzaldehyde Raw materials

5-Bromo-2-fluoro-3-methylbenzaldehyde Preparation Products

5-Bromo-2-fluoro-3-methylbenzaldehyde Related Literature

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