Cas no 140648-66-4 (2-Azetidinone, 4-methyl-1-[3-(trifluoromethyl)phenyl]-)

2-Azetidinone, 4-methyl-1-[3-(trifluoromethyl)phenyl]- structure
140648-66-4 structure
Product Name:2-Azetidinone, 4-methyl-1-[3-(trifluoromethyl)phenyl]-
CAS No:140648-66-4
MF:C11H10F3NO
MW:229.19841337204
CID:1295319
Update Time:2024-08-03

2-Azetidinone, 4-methyl-1-[3-(trifluoromethyl)phenyl]- Chemical and Physical Properties

Names and Identifiers

    • 2-Azetidinone, 4-methyl-1-[3-(trifluoromethyl)phenyl]-
    • Inchi: 1S/C11H10F3NO/c1-7-5-10(16)15(7)9-4-2-3-8(6-9)11(12,13)14/h2-4,6-7H,5H2,1H3
    • InChI Key: PRVXCMDNXPGGPN-UHFFFAOYSA-N
    • SMILES: N1(C2=CC=CC(C(F)(F)F)=C2)C(C)CC1=O

Computed Properties

  • Exact Mass: 229.0715

Experimental Properties

  • Density: 1.300±0.06 g/cm3(Predicted)
  • Boiling Point: 352.3±42.0 °C(Predicted)
  • PSA: 20.31
  • pka: -0.92±0.40(Predicted)
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