Cas no 499219-37-3 (1,2,3,4-Cyclopentanetetrol,5-[(2S)-3-[(11Z)-11-hexadecenyloxy]-2-hydroxypropoxy]-,(1S,2R,3R,4S)-)

1,2,3,4-Cyclopentanetetrol,5-[(2S)-3-[(11Z)-11-hexadecenyloxy]-2-hydroxypropoxy]-,(1S,2R,3R,4S)- structure
499219-37-3 structure
Product Name:1,2,3,4-Cyclopentanetetrol,5-[(2S)-3-[(11Z)-11-hexadecenyloxy]-2-hydroxypropoxy]-,(1S,2R,3R,4S)-
CAS No:499219-37-3
MF:C24H46O7
MW:446.617848873138
CID:1540466
Update Time:2024-08-24

1,2,3,4-Cyclopentanetetrol,5-[(2S)-3-[(11Z)-11-hexadecenyloxy]-2-hydroxypropoxy]-,(1S,2R,3R,4S)- Chemical and Physical Properties

Names and Identifiers

    • 1,2,3,4-Cyclopentanetetrol,5-[(2S)-3-[(11Z)-11-hexadecenyloxy]-2-hydroxypropoxy]-,(1S,2R,3R,4S)-
    • 1,2,3,4-Cyclopentanetetrol, 5-[(2S)-3-[(11Z)-11-hexadecen-1-yloxy]-2-hydroxypropoxy]-, (1S,2R,3R,4S)-
    • Inchi: 1S/C24H46O7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-30-17-19(25)18-31-24-22(28)20(26)21(27)23(24)29/h5-6,19-29H,2-4,7-18H2,1H3/b6-5+
    • InChI Key: LZBKVGIBSWELEF-AATRIKPKSA-N
    • SMILES: CCCC/C=C/CCCCCCCCCCOCC(COC1C(O)C(O)C(O)C1O)O

Computed Properties

  • Exact Mass: 446.32448

Experimental Properties

  • Density: 1.11±0.1 g/cm3(Predicted)
  • Boiling Point: 585.7±50.0 °C(Predicted)
  • PSA: 119.61
  • pka: 13.09±0.70(Predicted)
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