Hexa(beta-glucopyranosyl)glucitol

Base Information

• Chemical Name: Hexa(beta-glucopyranosyl)glucitol
• CAS No.: 93289-76-0
• Molecular Formula: C42H74O36
• Molecular Weight: 1155.0154
• Mol file: 93289-76-0.mol

Synonyms:HBGG;hexa(beta-D-glucopyranosyl)-D-glucitol;hexa(beta-glucopyranosyl)glucitol

Chemical Property of Hexa(beta-glucopyranosyl)glucitol

Chemical Property:

• Boiling Point: 1518°Cat760mmHg
• Flash Point: 871.9°C
• Density: 1.85g/cm³
• XLogP3: -14.8
• Hydrogen Bond Donor Count: 24
• Hydrogen Bond Acceptor Count: 36
• Rotatable Bond Count: 23
• Exact Mass: 1154.3959787
• Heavy Atom Count: 78
• Complexity: 1770

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(C1C(C(C(C(O1)OCC2C(C(C(C(O2)OCC3C(C(C(C(O3)OCC4C(C(C(C(O4)OCC(C(C(C(CO)O)O)O)O)O)OC5C(C(C(C(O5)CO)O)O)O)O)O)O)O)O)OC6C(C(C(C(O6)CO)O)O)O)O)O)O)O)O
• Isomeric SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@H]2[C@@H]([C@H](O[C@H]([C@@H]2O)OC[C@H]([C@H]([C@@H]([C@H](CO)O)O)O)O)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)COC5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O)O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)O)O)O)O)O)O)O