Cas no 65561-77-5 ((1R,3R,4S,5R)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]octan-4-ol)

(1R,3R,4S,5R)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]octan-4-ol structure
65561-77-5 structure
Product Name:(1R,3R,4S,5R)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]octan-4-ol
CAS No:65561-77-5
MF:C12H20O6
MW:260.283604621887
CID:962103
PubChem ID:11436872
Update Time:2025-04-19

(1R,3R,4S,5R)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]octan-4-ol Chemical and Physical Properties

Names and Identifiers

    • (1R,3R,4S,5R)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-7,7-dimethyl-2,6,8-trioxabicyclo[3.3.0]octan-4-ol
    • 65561-77-5
    • 1,2-5,6-Di-O-isopropyliden-alpha-d-glucofuranose
    • Inchi: 1S/C12H20O6/c1-11(2)14-5-6(16-11)8-7(13)9-10(15-8)18-12(3,4)17-9/h6-10,13H,5H2,1-4H3/t6?,7-,8-,9+,10+/m0/s1
    • InChI Key: KEJGAYKWRDILTF-XNMJNOLGSA-N
    • SMILES: O1[C@H]2[C@@H]([C@H]([C@@H]1C1COC(C)(C)O1)O)OC(C)(C)O2

Computed Properties

  • Exact Mass: 260.12598835g/mol
  • Monoisotopic Mass: 260.12598835g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 342
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 4
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0
  • Topological Polar Surface Area: 66.4?2
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