Eupatoriopicrine

Base Information

• Chemical Name: Eupatoriopicrine
• CAS No.: 6856-01-5
• Molecular Formula: C₂₀H₂₆O₆
• Molecular Weight: 362.423
• Wikidata: Q76386582
• Mol file: 6856-01-5.mol

Synonyms:eupatoriopicrin;eupatoriopicrine

Chemical Property of Eupatoriopicrine

Chemical Property:

• Vapor Pressure: 6.69E-16mmHg at 25°C
• Refractive Index: 1.4450 (estimate)
• Boiling Point: 580.7°C at 760 mmHg
• Flash Point: 204°C
• PSA: 93.06000
• Density: 1.21g/cm³
• LogP: 1.98350
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 362.17293854
• Heavy Atom Count: 26
• Complexity: 670

Purity/Quality:

Analysis control,97.5% ^*data from raw suppliers

Eupatoriopicrin 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2C(C(CC(=CCC1)C)OC(=O)C(=CCO)CO)C(=C)C(=O)O2
• Isomeric SMILES: C/C/1=C/[C@@H]2[C@@H]([C@@H](C/C(=C\CC1)/C)OC(=O)/C(=C/CO)/CO)C(=C)C(=O)O2