Cas no 100402-56-0 (d-Glucose, ether with 1,4-anhydro-d-glucitol)

d-Glucose, ether with 1,4-anhydro-d-glucitol structure
100402-56-0 structure
Product Name:d-Glucose, ether with 1,4-anhydro-d-glucitol
CAS No:100402-56-0
MF:C6H12O5
MW:164.156482696533
CID:184972
PubChem ID:10953859
Update Time:2025-04-19

d-Glucose, ether with 1,4-anhydro-d-glucitol Chemical and Physical Properties

Names and Identifiers

    • d-Glucose, ether with 1,4-anhydro-d-glucitol
    • 1,4-ANHYDRO-D-GLUCITOL
    • 1,4-ANHYDRO-D-SORBITOL
    • Einecs 309-491-9
    • 27299-12-3
    • NS00011485
    • DTXSID20893390
    • UNII-6O92ICV9RU
    • 1,4-Sorbitan
    • 12441-09-7
    • AT36238
    • 1,4-SORBITAN [USP-RS]
    • DB14474
    • CS-0208700
    • JNYAEWCLZODPBN-JGWLITMVSA-N
    • Sorbitan
    • DTXSID50893383
    • EINECS 235-671-0
    • 1,4-anhydrosorbitol
    • W-202151
    • 100402-56-0
    • 1,4-Anhydroglucitol
    • AV0YTZ4E6J
    • Q59951142
    • 28218-56-6
    • (2R,3R,4S)-2-[(1R)-1,2-dihydroxyethyl]oxolane-3,4-diol
    • 6O92ICV9RU
    • (2R,3R,4S)-2-((R)-1,2-Dihydroxyethyl)tetrahydrofuran-3,4-diol
    • EINECS 248-391-9
    • SCHEMBL1386
    • AKOS006274480
    • UNII-AV0YTZ4E6J
    • Inchi： 1S/C6H12O5/c7-1-3(8)6-5(10)4(9)2-11-6/h3-10H,1-2H2/t3-,4+,5-,6-/m1/s1
    • InChI Key： JNYAEWCLZODPBN-JGWLITMVSA-N
    • SMILES： O1C[C@@H]([C@H]([C@H]1[C@@H](CO)O)O)O

Computed Properties

  • Exact Mass: 164.06800
  • Monoisotopic Mass: 164.06847348g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 128
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -2.1
  • Topological Polar Surface Area: 90.2?2

Experimental Properties

  • Melting Point: 112-113°C
  • PSA: 90.15000
  • LogP: -2.53980

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