Vesiculosin

Base Information

• Chemical Name: Vesiculosin
• CAS No.: 96935-20-5
• Molecular Formula: C30H42O9
• Molecular Weight: 546.6491
• NSC Number: 374342
• Mol file: 96935-20-5.mol

Synonyms:vesiculosin

Chemical Property of Vesiculosin

Chemical Property:

• Vapor Pressure: 7.54E-24mmHg at 25°C
• Boiling Point: 718.6°Cat760mmHg
• Flash Point: 229.8°C
• PSA: 157.05000
• Density: 1.31g/cm³
• LogP: 1.66590
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 10
• Exact Mass: 546.28288291
• Heavy Atom Count: 39
• Complexity: 1110

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC=CC=CC(=O)OC1C2C3C(O3)(C(C4(C(C2(C(CC1(C(=C)C)O)C)O)C=C(C4=O)C)O)O)CO
• Isomeric SMILES: CCCCC/C=C/C=C/C(=O)OC1C2C3C(O3)(C(C4(C(C2(C(CC1(C(=C)C)O)C)O)C=C(C4=O)C)O)O)CO