Cascaroside

Base Information

• Chemical Name: Cascaroside
• CAS No.: 53823-08-8
• Molecular Formula: C27H32O14
• Molecular Weight: 580.53
• Mol file: 53823-08-8.mol

Synonyms:Cascaroside;1-hydroxy-3-(hydroxymethyl)-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-8-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-10H-anthracen-9-one

Chemical Property of Cascaroside

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.726
• Boiling Point: 948.1 °C at 760 mmHg
• PKA: 7.32±0.40(Predicted)
• Flash Point: 315.2 °C
• PSA: 247.06000
• Density: 1.694 g/cm³
• LogP: -3.41810
• XLogP3: -1.9
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 6
• Exact Mass: 580.17920569
• Heavy Atom Count: 41
• Complexity: 907

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C(=C1)OC3C(C(C(C(O3)CO)O)O)O)C(=O)C4=C(C2C5C(C(C(C(O5)CO)O)O)O)C=C(C=C4O)CO