Cas no 25018-27-3 (Trehalose octaacetate)

Trehalose octaacetate structure
Trehalose octaacetate structure
Product Name:Trehalose octaacetate
CAS No:25018-27-3
MF:C28H38O19
MW:678.5899310112
CID:269331
PubChem ID:345998
Update Time:2025-04-19

Trehalose octaacetate Chemical and Physical Properties

Names and Identifiers

    • a-D-Glucopyranoside,2,3,4,6-tetra-O-acetyl-a-D-glucopyranosyl, 2,3,4,6-tetraacetate
    • [3,4,5-triacetyloxy-6-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
    • TREHALOSE OCTAACETATE
    • 2,3,4,6-Tetra-O-acetylhexopyranosyl 2,3,4,6-tetra-O-acetylhexopyranoside
    • Kojibiose peracetate
    • HWDSLHMSWAHPBA-UHFFFAOYSA-N
    • 25018-27-3
    • [3, 4, 5-triacetyloxy-6-[3, 4, 5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
    • NSC-403987
    • DTXSID60323429
    • NSC403987
    • 2,3,4,6-Tetra-O-acetylhexopyranosyl 2,3,4,6-tetra-O-acetylhexopyranoside #
    • TREHALOSE, OCTAACETATE
    • SCHEMBL23651802
    • Trehalose octaacetate
    • Inchi: 1S/C28H38O19/c1-11(29)37-9-19-21(39-13(3)31)23(41-15(5)33)25(43-17(7)35)27(45-19)47-28-26(44-18(8)36)24(42-16(6)34)22(40-14(4)32)20(46-28)10-38-12(2)30/h19-28H,9-10H2,1-8H3
    • InChI Key: HWDSLHMSWAHPBA-UHFFFAOYSA-N
    • SMILES: O(C1C(C(C(C(COC(C)=O)O1)OC(C)=O)OC(C)=O)OC(C)=O)C1C(C(C(C(COC(C)=O)O1)OC(C)=O)OC(C)=O)OC(C)=O

Computed Properties

  • Exact Mass: 678.20100
  • Monoisotopic Mass: 678.201
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 19
  • Heavy Atom Count: 47
  • Rotatable Bond Count: 20
  • Complexity: 1110
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 10
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 238A^2
  • XLogP3: -0.7

Experimental Properties

  • Density: 1.37
  • Boiling Point: 657.3°Cat760mmHg
  • Flash Point: 270.5°C
  • Refractive Index: 1.507
  • PSA: 238.09000
  • LogP: -0.83080

Trehalose octaacetate Pricemore >>

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