Podolactone E

Base Information

• Chemical Name: Podolactone E
• CAS No.: 37070-59-0
• Molecular Formula: C18H18 O6
• Molecular Weight: 332.3478
• DSSTox Substance ID: DTXSID00958234
• Wikidata: Q82938743
• Mol file: 37070-59-0.mol

Synonyms:podolactone E

Chemical Property of Podolactone E

Chemical Property:

• Vapor Pressure: 3.42E-16mmHg at 25°C
• Boiling Point: 586.4°Cat760mmHg
• Flash Point: 218.3°C
• PSA: 85.36000
• Density: 1.41g/cm³
• LogP: 0.74020
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 332.12598835
• Heavy Atom Count: 24
• Complexity: 712

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC12C3CC(=O)OC(C3=CC4C1C(C(C5C2O5)O)(C(=O)O4)C)C=C
• Isomeric SMILES: C[C@@]12[C@@H]3[C@@H](C=C4[C@H](OC(=O)CC4[C@]3([C@@H]5[C@H]([C@@H]1O)O5)C)C=C)OC2=O