Cas no 352439-40-8 (Dodecanoic acid, 12-(acetylthio)-)

Dodecanoic acid, 12-(acetylthio)- structure
352439-40-8 structure
Product Name:Dodecanoic acid, 12-(acetylthio)-
CAS No:352439-40-8
MF:C14H26O3S
MW:274.41944360733
CID:1476589
Update Time:2024-08-24

Dodecanoic acid, 12-(acetylthio)- Chemical and Physical Properties

Names and Identifiers

    • Dodecanoic acid, 12-(acetylthio)-
    • Inchi: 1S/C14H26O3S/c1-13(15)18-12-10-8-6-4-2-3-5-7-9-11-14(16)17/h2-12H2,1H3,(H,16,17)
    • InChI Key: UDIHINGPFGORMG-UHFFFAOYSA-N
    • SMILES: C(O)(=O)CCCCCCCCCCCSC(C)=O

Computed Properties

  • Exact Mass: 274.16038

Experimental Properties

  • Density: 1.034±0.06 g/cm3(Predicted)
  • Boiling Point: 406.8±18.0 °C(Predicted)
  • PSA: 54.37
  • pka: 4.78±0.10(Predicted)
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