Cas no 20857-46-9 (3,4-Bis(trifluoromethyl)pyridine)

3,4-Bis(trifluoromethyl)pyridine is a fluorinated pyridine derivative characterized by the presence of two trifluoromethyl groups at the 3- and 4-positions of the pyridine ring. This structural feature enhances its electron-withdrawing properties, making it a valuable intermediate in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and specialty materials. The compound exhibits high thermal and chemical stability due to the strong C-F bonds, while its aromatic pyridine core allows for further functionalization. Its unique electronic properties also make it useful in ligand design for catalysis. The compound is typically handled under inert conditions due to its sensitivity to moisture and air.
3,4-Bis(trifluoromethyl)pyridine structure
20857-46-9 structure
Product Name:3,4-Bis(trifluoromethyl)pyridine
CAS No:20857-46-9
MF:C7H3F6N
MW:215.095842599869
MDL:MFCD08686956
CID:88228
PubChem ID:14937917
Update Time:2025-06-09

3,4-Bis(trifluoromethyl)pyridine Chemical and Physical Properties

Names and Identifiers

    • 3,4-Bis(trifluoromethyl)pyridine
    • 3,4-Bis-trifluormethyl-pyridin
    • 3,4-bis-trifluoromethyl-pyridine
    • FT-0678013
    • W-206567
    • Pyridine,3,4-bis(trifluoromethyl)-
    • 20857-46-9
    • AKOS005063724
    • MS-20011
    • SCHEMBL20772453
    • SVYGFFYEEPFDOC-UHFFFAOYSA-N
    • MFCD08686956
    • CS-0316354
    • Pyridine, 3,4-bis(trifluoromethyl)-
    • DTXSID80565743
    • DB-066354
    • 3,4-Bis(trifluoromethyl)-pyridine
    • BBL100384
    • STL554178
    • MDL: MFCD08686956
    • Inchi: 1S/C7H3F6N/c8-6(9,10)4-1-2-14-3-5(4)7(11,12)13/h1-3H
    • InChI Key: SVYGFFYEEPFDOC-UHFFFAOYSA-N
    • SMILES: FC(C1C=CN=CC=1C(F)(F)F)(F)F

Computed Properties

  • Exact Mass: 215.01700
  • Monoisotopic Mass: 215.01696807g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 195
  • 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: nothing
  • XLogP3: 2.6
  • Topological Polar Surface Area: 12.9?2

Experimental Properties

  • Color/Form: {"from":"zh","to":"en","trans_result":[{"src":"\u672a\u786e\u5b9a","dst":"Not determined"},{"src":"2.\u00a0\u5bc6\u5ea6\uff08g\/mL,25\/4\u2103\uff09","dst":"2. density (g\/ml, 25\/4 \u2103)"}]}
  • Density: 1.437
  • Boiling Point: 42-44°C/24mm
  • Flash Point: 42-44°C/24mm
  • Refractive Index: 1.3920
  • PSA: 12.89000
  • LogP: 3.11920

3,4-Bis(trifluoromethyl)pyridine Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT, MOISTURE SENSITIVE

3,4-Bis(trifluoromethyl)pyridine Customs Data

  • HS CODE:2933399090
  • Customs Data:

    China Customs Code:

    2933399090

    Overview:

    2933399090. Other compounds with non fused pyridine rings in structure. 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:

    2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

3,4-Bis(trifluoromethyl)pyridine Pricemore >>

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