Cas no 101377-33-7 (2,6,10,14,18,22,26-Heptaoxaheptacosane-4,12,20-triol,1,27-bis(2-oxiranyl)-8,16,24-tris(2-oxiranylmethoxy)-)

2,6,10,14,18,22,26-Heptaoxaheptacosane-4,12,20-triol,1,27-bis(2-oxiranyl)-8,16,24-tris(2-oxiranylmethoxy)- structure
101377-33-7 structure
Product Name:2,6,10,14,18,22,26-Heptaoxaheptacosane-4,12,20-triol,1,27-bis(2-oxiranyl)-8,16,24-tris(2-oxiranylmethoxy)-
CAS No:101377-33-7
MF:C33H58O18
MW:742.802833080292
CID:162131
PubChem ID:113594
Update Time:2025-04-19

2,6,10,14,18,22,26-Heptaoxaheptacosane-4,12,20-triol,1,27-bis(2-oxiranyl)-8,16,24-tris(2-oxiranylmethoxy)- Chemical and Physical Properties

Names and Identifiers

    • 2,6,10,14,18,22,26-Heptaoxaheptacosane-4,12,20-triol,1,27-bis(2-oxiranyl)-8,16,24-tris(2-oxiranylmethoxy)-
    • 1,27-bis(oxiranyl)-8,16,24-tris(oxiranylmethoxy)-2,6,10,14,18,22,26-heptaoxaheptacosane-4,12,20-triol
    • 1-[3-[3-[3-[3-[2,3-bis(oxiran-2-ylmethoxy)propoxy]-2-hydroxypropoxy]-2-(oxiran-2-ylmethoxy)propoxy]-2-hydroxypropoxy]-2-(oxiran-2-ylmethoxy)propoxy]-3-(oxiran-2-ylmethoxy)propan-2-ol
    • 1,27-di(oxiran-2-yl)-8,16,24-tris(oxiran-2-ylmethoxy)-2,6,10,14,18,22,26-heptaoxaheptacosane-4,12,20-triol
    • 2,6,10,14,18,22,26-Heptaoxaheptacosane-4,12,20-triol, 1,27-bis(oxiranyl)-8,16,24-tris(oxiranylmethoxy)-
    • SCHEMBL20010334
    • NS00065343
    • EINECS 309-934-6
    • DTXSID20906095
    • 1,27-Bis(oxiran-2-yl)-8,16,24-tris[(oxiran-2-yl)methoxy]-2,6,10,14,18,22,26-heptaoxaheptacosane-4,12,20-triol
    • 101377-33-7
    • Inchi: 1S/C33H58O18/c34-23(2-38-9-27(45-18-32-21-50-32)10-40-5-25(36)6-42-13-29-15-47-29)1-37-7-26(44-17-31-20-49-31)8-39-3-24(35)4-41-11-28(46-19-33-22-51-33)12-43-14-30-16-48-30/h23-36H,1-22H2
    • InChI Key: PGPNHSXRNWRZOB-UHFFFAOYSA-N
    • SMILES: O1CC1COC(COCC(COCC(COCC(COCC(COCC(COCC1CO1)O)OCC1CO1)O)OCC1CO1)O)COCC1CO1

Computed Properties

  • Exact Mass: 742.36234
  • Monoisotopic Mass: 742.36231500g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 18
  • Heavy Atom Count: 51
  • Rotatable Bond Count: 37
  • Complexity: 906
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 11
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -4.4
  • Topological Polar Surface Area: 216?2

Experimental Properties

  • PSA: 215.64
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