Cas no 102787-19-9 (a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetrakis(2-methylpropanoate))

a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetrakis(2-methylpropanoate) structure
102787-19-9 structure
Product Name:a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetrakis(2-methylpropanoate)
CAS No:102787-19-9
MF:C44H70O19
MW:903.015216350555
CID:141109
PubChem ID:128201
Update Time:2025-04-19

a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetrakis(2-methylpropanoate) Chemical and Physical Properties

Names and Identifiers

    • a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetrakis(2-methylpropanoate)
    • [(2R,3R,4S,5R,6R)-6-[(2S,3S,4R,5R)-3,4-bis(2-methylpropanoyloxy)-2,5-bis(2-methylpropanoyloxymethyl)oxolan-2-yl]oxy-3,4,5-tris(2-methylpropanoyloxy)oxan-2-yl]methyl 2-methylpropanoate
    • a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetr...
    • sucrose octaisobutyrate
    • 1,3,4,6-tetrakis-O-(2-methylpropanoyl)-beta-D-fructofuranosyl 2,3,4,6-tetrakis-O-(2-methylpropanoyl)-alpha-D-glucopyranoside
    • alpha-D-Glucopyranoside, 1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-beta-D-fructofuranosyl, tetrakis(2-methylpropanoate)
    • Sucrose octa-isobutyrate
    • SCHEMBL4268023
    • UNII-O7704K0GMS
    • DTXSID00145506
    • Q27285434
    • O7704K0GMS
    • 102787-19-9
    • Inchi： 1S/C44H70O19/c1-20(2)35(45)53-17-28-30(57-38(48)23(7)8)32(59-40(50)25(11)12)33(60-41(51)26(13)14)43(56-28)63-44(19-55-37(47)22(5)6)34(61-42(52)27(15)16)31(58-39(49)24(9)10)29(62-44)18-54-36(46)21(3)4/h20-34,43H,17-19H2,1-16H3/t28-,29-,30-,31-,32+,33-,34+,43-,44+/m1/s1
    • InChI Key： QSOGLNCCKWUXRN-CIGKAFDASA-N
    • SMILES： O1[C@H](COC(C(C)C)=O)[C@H]([C@@H]([C@]1(COC(C(C)C)=O)O[C@@H]1[C@@H]([C@H]([C@@H]([C@@H](COC(C(C)C)=O)O1)OC(C(C)C)=O)OC(C(C)C)=O)OC(C(C)C)=O)OC(C(C)C)=O)OC(C(C)C)=O

Computed Properties

  • Exact Mass: 902.4512
  • Monoisotopic Mass: 902.451
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 19
  • Heavy Atom Count: 63
  • Rotatable Bond Count: 29
  • Complexity: 1600
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 9
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 7.4
  • Topological Polar Surface Area: 238?2

Experimental Properties

  • Density: 1.19
  • Boiling Point: 788.1°Cat760mmHg
  • Flash Point: 303.2°C
  • Refractive Index: 1.498
  • PSA: 238.09

a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetrakis(2-methylpropanoate) Related Literature

102787-19-9 (a-D-Glucopyranoside,1,3,4,6-tetrakis-O-(2-methyl-1-oxopropyl)-b-D-fructofuranosyl,2,3,4,6-tetrakis(2-methylpropanoate)) Related Products

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