Cas no 887268-18-0 (1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene)

1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene is a synthetic organic compound with significant applications in the pharmaceutical and agrochemical industries. It features a bromo substituent and a trifluoromethyl group, which contribute to its unique reactivity and selectivity. This compound offers high purity and stability, facilitating precise chemical transformations and efficient synthesis of target molecules. Its structural complexity and tunable reactivity make it a valuable intermediate for the development of advanced pharmaceuticals and agrochemicals.
1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene structure
887268-18-0 structure
Product Name:1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene
CAS No:887268-18-0
MF:C9H8BrF3
MW:253.059032440186
CID:891309
PubChem ID:44717342
Update Time:2025-07-19

1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene Chemical and Physical Properties

Names and Identifiers

    • 1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene
    • 1-BROMO-2,5-DIMETHYL-4-TRIFLUOROMETHYL-BENZENE
    • 4-bromo-2,5-dimethylbenzotrifluoride
    • JQFCVKLDNIXKPP-UHFFFAOYSA-N
    • AKOS015891409
    • DTXSID30660151
    • 2,5-dimethyl-4-trifluoromethyl-bromobenzene
    • 887268-18-0
    • MFCD04972687
    • DB-205715
    • 2,5-Dimethyl-4-(trifluoromethyl)bromobenzene
    • MDL: MFCD04972687
    • Inchi: 1S/C9H8BrF3/c1-5-4-8(10)6(2)3-7(5)9(11,12)13/h3-4H,1-2H3
    • InChI Key: JQFCVKLDNIXKPP-UHFFFAOYSA-N
    • SMILES: BrC1=CC(C)=C(C(F)(F)F)C=C1C

Computed Properties

  • Exact Mass: 251.97615g/mol
  • Monoisotopic Mass: 251.97615g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 178
  • 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: 4.2
  • Topological Polar Surface Area: 0?2

1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene Security Information

  • Hazard Statement: Irritant
  • Hazardous Material Identification: Xi

1-Bromo-2,5-dimethyl-4-(trifluoromethyl)benzene Pricemore >>

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