Cyclolinteinone

Base Information

• Chemical Name: Cyclolinteinone
• CAS No.: 159934-16-4
• Molecular Formula: C25H36 O3
• Molecular Weight: 384.55
• Nikkaji Number: J1.247.191B
• Wikidata: Q105347854
• Metabolomics Workbench ID: 173720
• Mol file: 159934-16-4.mol

Synonyms:cyclolinteinone

Chemical Property of Cyclolinteinone

Chemical Property:

• Vapor Pressure: 8.33E-12mmHg at 25°C
• Boiling Point: 541.9°C at 760 mmHg
• Flash Point: 232°C
• PSA: 43.37000
• Density: 0.997g/cm³
• LogP: 6.26430
• XLogP3: 5.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 384.26644501
• Heavy Atom Count: 28
• Complexity: 720

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1CC(=O)C=C(C1(C)CCC(=CCCC(=CCCC2=CC(=O)OC2)C)C)C
• Isomeric SMILES: C[C@@H]1CC(=O)C=C([C@]1(C)CC/C(=C/CC/C(=C/CCC2=CC(=O)OC2)/C)/C)C