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CS-W001157 4
Total: USD 88.00

1,2-Dimethyl-4-(trifluoromethyl)benzene

  • CAS No. 78164-31-5

  • Cat. No. CS-0077626
  • Molecule weight174.16
  • Purity≥97%
  • MDL No.MFCD00079783

*For research and further manufacturing use only, not for direct human use.

1,2-Dimethyl-4-(trifluoromethyl)benzene|CS-0077626

Structure of 78164-31-5

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General Information

  • CAS No. 78164-31-5
  • Cat. No. CS-0077626
  • Purity ≥97%
  • MDL No. MFCD00079783
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉F₃
  • Molecular Weight 174.16
  • Synonym(s) 3,4-Dimethylbenzotrifluoride
  • SMILES CC1=C(C)C=CC(C(F)(F)F)=C1

Synthesis

  • Route1

    References

    • Saltigo GmbH Patent: EP2447239 A1, 2012 ; Location in patent: Page/Page column 5 ;
  • Route2
    • null|null
      431-47-0
    • null|null
      583-71-1
    • ~58%
    • 1,2-Dimethyl-4-(trifluoromethyl)benzene|CS-0077626
      78164-31-5

    References

    • Saltigo GmbH Patent: EP2447239 A1, 2012 ; Location in patent: Page/Page column 5-6 ;
  • Route3
    • null|null
      71740-88-0
    • ~91%
    • 1,2-Dimethyl-4-(trifluoromethyl)benzene|CS-0077626
      78164-31-5

    References

    • Pawlowski, Georg; Hanack, Michael Synthetic Communications, 1981 , vol. 11, # 5 p. 351 - 364

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.32224
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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