Icariside B1

Base Information

• Chemical Name: Icariside B1
• CAS No.: 109062-00-2
• Molecular Formula: C₁₉H₃₀O₈
• Molecular Weight: 386.442
• Nikkaji Number: J1.989.237I,J2.020.854F
• Mol file: 109062-00-2.mol

Synonyms:icariside B1

Chemical Property of Icariside B1

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 602.674°C at 760 mmHg
• PKA: 12.91±0.70(Predicted)
• Flash Point: 210.427°C
• PSA: 136.68000
• Density: 1.301g/cm³
• LogP: -1.22310
• XLogP3: -1.6
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 386.19406791
• Heavy Atom Count: 27
• Complexity: 623

Purity/Quality:

99%+, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=O)C=C=C1C(CC(CC1(C)O)OC2C(C(C(C(O2)CO)O)O)O)(C)C
• Isomeric SMILES: CC(=O)C=C=C1[C@](C[C@H](CC1(C)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)(C)O