Diplodiatoxin

Base Information

• Chemical Name: Diplodiatoxin
• CAS No.: 41060-01-9
• Molecular Formula: C18H28O4
• Molecular Weight: 308.4125
• Metabolomics Workbench ID: 115457
• Wikidata: Q77280157
• Mol file: 41060-01-9.mol

Synonyms:diplodiatoxin

Chemical Property of Diplodiatoxin

Chemical Property:

• Vapor Pressure: 1.41E-10mmHg at 25°C
• Boiling Point: 464.4°Cat760mmHg
• Flash Point: 248.8°C
• PSA: 74.60000
• Density: 1.079g/cm³
• LogP: 2.90330
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 308.19875937
• Heavy Atom Count: 22
• Complexity: 495

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(C2C(C1)C=C(C(C2(C)C(=O)CCO)C(=O)O)C)C