Cas no 668421-08-7 (1,4,17,20-Tetraoxacyclotetracontane-5,16,21,40-tetrone,2,18-bis(hydroxymethyl)-, (2S,18S)-)

1,4,17,20-Tetraoxacyclotetracontane-5,16,21,40-tetrone,2,18-bis(hydroxymethyl)-, (2S,18S)- structure
668421-08-7 structure
Product Name:1,4,17,20-Tetraoxacyclotetracontane-5,16,21,40-tetrone,2,18-bis(hydroxymethyl)-, (2S,18S)-
CAS No:668421-08-7
MF:C38H68O10
MW:684.940533638
CID:1718825
Update Time:2024-11-27

1,4,17,20-Tetraoxacyclotetracontane-5,16,21,40-tetrone,2,18-bis(hydroxymethyl)-, (2S,18S)- Chemical and Physical Properties

Names and Identifiers

    • 1,4,17,20-Tetraoxacyclotetracontane-5,16,21,40-tetrone,2,18-bis(hydroxymethyl)-, (2S,18S)-
    • 1,4,17,20-Tetraoxacyclotetracontane-5,16,21,40-tetrone, 2,18-bis(hydroxymethyl)-, (2S,18S)-
    • Inchi: 1S/C38H68O10/c39-29-33-32-46-36(42)26-22-18-14-11-12-16-20-24-28-38(44)48-34(30-40)31-45-35(41)25-21-17-13-9-7-5-3-1-2-4-6-8-10-15-19-23-27-37(43)47-33/h33-34,39-40H,1-32H2/t33-,34-/m0/s1
    • InChI Key: DSONBHABWWJIOS-HEVIKAOCSA-N
    • SMILES: O1C(=O)CCCCCCCCCCCCCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCCCCCC(=O)OC[C@@H]1CO

Computed Properties

  • Exact Mass: 684.48144

Experimental Properties

  • Density: 0.982±0.06 g/cm3(Predicted)
  • Boiling Point: 757.1±27.0 °C(Predicted)
  • PSA: 145.66
  • pka: 13.39±0.10(Predicted)

1,4,17,20-Tetraoxacyclotetracontane-5,16,21,40-tetrone,2,18-bis(hydroxymethyl)-, (2S,18S)- Related Literature

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