Cas no 402-12-0 (3-Fluoro-4-nitrobenzotrifluoride)

3-Fluoro-4-nitrobenzotrifluoride structure
402-12-0 structure
Product Name:3-Fluoro-4-nitrobenzotrifluoride
CAS No:402-12-0
MF:C7H3F4NO2
MW:209.09783577919
MDL:MFCD03840208
CID:328154
PubChem ID:3722169
Update Time:2025-04-19

3-Fluoro-4-nitrobenzotrifluoride Chemical and Physical Properties

Names and Identifiers

    • Benzene,2-fluoro-1-nitro-4-(trifluoromethyl)-
    • 2-fluoro-1-nitro-4-(trifluoromethyl)benzene
    • 3-Fluoro-4-nitrobenzotrifluoride
    • 402-12-0
    • A21376
    • AS-33182
    • Benzene, 2-fluoro-1-nitro-4-(trifluoromethyl)-
    • DTXSID00395524
    • 2-Fluoro-1-nitro-4-trifluoromethyl-benzene
    • MFCD03840208
    • AC-4141
    • A900534
    • CS-0033211
    • FT-0602728
    • 3-fluoro-4-nitrobenzotrifluoride, AldrichCPR
    • SY075503
    • AKOS005063752
    • AM61959
    • SCHEMBL113070
    • 2-Fluoro-4-(trifluoromethyl)nitrobenzene
    • MDL： MFCD03840208
    • Inchi： 1S/C7H3F4NO2/c8-5-3-4(7(9,10)11)1-2-6(5)12(13)14/h1-3H
    • InChI Key： OBWDPLOCTVOTMA-UHFFFAOYSA-N
    • SMILES： FC1=C(C=CC(C(F)(F)F)=C1)[N+](=O)[O-]

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: 2.2
  • Topological Polar Surface Area: 45.8?2

Experimental Properties

  • Density: 1.504±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 219.9±40.0 oC (760 Torr),
  • Flash Point: 86.8±27.3 oC,
  • Solubility: Very slightly soluble (0.14 g/l) (25 o C),
  • PSA: 45.82000
  • LogP: 3.27590

3-Fluoro-4-nitrobenzotrifluoride Security Information

  • Hazard Statement： Irritant
  • Hazard Category Code： 34
  • Safety Instruction： 39
  • Hazardous Material Identification： Xi

3-Fluoro-4-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%

3-Fluoro-4-nitrobenzotrifluoride Pricemore >>

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