Cas no 454-73-9 (3-Fluoro-5-nitrobenzotrifluoride)

3-Fluoro-5-nitrobenzotrifluoride structure
454-73-9 structure
Product Name:3-Fluoro-5-nitrobenzotrifluoride
CAS No:454-73-9
MF:C7H3F4NO2
MW:209.09783577919
MDL:MFCD07779168
CID:37499
PubChem ID:15272400
Update Time:2025-04-18

3-Fluoro-5-nitrobenzotrifluoride Chemical and Physical Properties

Names and Identifiers

    • 3-Fluoro-5-nitro-1-trifluoromethylbenzene
    • 3-Fluoro-5-nitrobenzotrifluoride
    • 1-Fluoro-3-nitro-5-(trifluoromethyl)benzene
    • Benzene, 1-fluoro-3-nitro-5-(trifluoromethyl)-
    • 1-Fluor-3-nitro-5-trifluormethyl-benzol
    • 1-fluoro-3-nitro-5-trifluoromethyl-benzene
    • 3-fluoro-5-trifluoromethyl-nitrobenzene
    • 5-FLUORO-3-(TRIFLUOROMETHYL)NITROBENZENE
    • AKOS015890564
    • 1-fluoro-3-(trifluoromethyl)-5-nitrobenzene
    • SCHEMBL1505899
    • CS-W003426
    • MFCD07779168
    • 3-Fluoro-5-trifluoromethylnitrobenzene
    • 454-73-9
    • AC-5754
    • FT-0687065
    • 3-CHLOROTETRAFLUOROPROPIONYLFLUORIDE
    • DTXSID90570823
    • LPJMOFDMJUNDEW-UHFFFAOYSA-N
    • A826815
    • GS-4005
    • J-512535
    • AM20050182
    • 1-fluoro-3-nitro-5-(trifluoromethyl)benzene;3-Fluoro-5-nitro-1-trifluoromethylbenzene
    • SY030045
    • 3-Fluoro-5-nitrobenzotrifluroide
    • benzene, 1-fluoro-3-nitro-5-(trifluoromethyl)-;
    • DTXCID70521595
    • MDL： MFCD07779168
    • Inchi： 1S/C7H3F4NO2/c8-5-1-4(7(9,10)11)2-6(3-5)12(13)14/h1-3H
    • InChI Key： RKLBCPTURHSIOJ-UHFFFAOYSA-N
    • SMILES： FC(C1C=C(C=C(C=1)[N+](=O)[O-])F)(F)F

Computed Properties

  • Exact Mass: 209.01000
  • Monoisotopic Mass: 209.00999099g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 225
  • 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: 45.8?2

Experimental Properties

  • PSA: 45.82000
  • LogP: 3.27590

3-Fluoro-5-nitrobenzotrifluoride Security Information

3-Fluoro-5-nitrobenzotrifluoride Customs Data

  • HS CODE：2904909090
  • Customs Data：

    China Customs Code:

    2904909090

    Overview:

    2904909090 Sulfonation of other hydrocarbons\nitrification\Nitrosative derivative(Whether halogenated or not). 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:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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3-Fluoro-5-nitrobenzotrifluoride Production Method

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