Cas no 496784-29-3 (Phenol, 4-(1,3-dithian-2-yl)-2-methoxy-, acetate)

Phenol, 4-(1,3-dithian-2-yl)-2-methoxy-, acetate structure
496784-29-3 structure
Product Name:Phenol, 4-(1,3-dithian-2-yl)-2-methoxy-, acetate
CAS No:496784-29-3
MF:C13H16O3S2
MW:284.394341468811
CID:1525065
Update Time:2024-08-24

Phenol, 4-(1,3-dithian-2-yl)-2-methoxy-, acetate Chemical and Physical Properties

Names and Identifiers

    • Phenol, 4-(1,3-dithian-2-yl)-2-methoxy-, acetate
    • Phenol, 4-(1,3-dithian-2-yl)-2-methoxy-, 1-acetate
    • Inchi: 1S/C13H16O3S2/c1-9(14)16-11-5-4-10(8-12(11)15-2)13-17-6-3-7-18-13/h4-5,8,13H,3,6-7H2,1-2H3
    • InChI Key: OJOIAJRNRZXGIA-UHFFFAOYSA-N
    • SMILES: C1(OC(=O)C)=CC=C(C2SCCCS2)C=C1OC

Computed Properties

  • Exact Mass: 302.06474

Experimental Properties

  • Density: 1.229±0.06 g/cm3(Predicted)
  • Melting Point: 122-124 °C
  • Boiling Point: 399.6±42.0 °C(Predicted)
  • PSA: 66.76

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