6-O-(2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl)-D-glucose 2,3,4,5-tetraacetate

Base Information

• Chemical Name: 6-O-(2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl)-D-glucose 2,3,4,5-tetraacetate
• CAS No.: 53270-74-9
• Molecular Formula: C28H38 O19
• Molecular Weight: 678.58992
• European Community (EC) Number: 258-454-2
• DSSTox Substance ID: DTXSID70967853
• Nikkaji Number: J295.918F
• Wikidata: Q82950496
• Mol file: 53270-74-9.mol

Synonyms:cellobiose octaacetate

Chemical Property of 6-O-(2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl)-D-glucose 2,3,4,5-tetraacetate

Chemical Property:

• Vapor Pressure: 3.58E-19mmHg at 25°C
• Boiling Point: 695.1°C at 760 mmHg
• Flash Point: 285.6°C
• PSA: 39.07000
• Density: 1.34g/cm³
• LogP: 3.59530
• XLogP3: -1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 19
• Rotatable Bond Count: 24
• Exact Mass: 678.20072898
• Heavy Atom Count: 47
• Complexity: 1180

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OCC1C(C(C(C(O1)OCC(C(C(C(C=O)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
• Isomeric SMILES: CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OC[C@H]([C@H]([C@@H]([C@H](C=O)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C