Linderalactone

Base Information

• Chemical Name: Linderalactone
• CAS No.: 728-61-0
• Deprecated CAS: 32663-41-5,857366-20-2
• Molecular Formula: C15H16O3
• Molecular Weight: 244.2857
• Wikidata: Q27137414
• Metabolomics Workbench ID: 121661
• ChEMBL ID: CHEMBL1080239
• Mol file: 728-61-0.mol

Synonyms:isolinderalactone;linderalactone

Chemical Property of Linderalactone

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 136-138 °C
• Boiling Point: 437.9°Cat760mmHg
• Flash Point: 218.6°C
• PSA: 39.44000
• Density: 1.19g/cm³
• LogP: 3.39490
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 244.109944368
• Heavy Atom Count: 18
• Complexity: 422

Purity/Quality:

98%,99%, ^*data from raw suppliers

Linderalactone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CCCC2=CC(C3=C(C1)OC=C3C)OC2=O
• Isomeric SMILES: C/C/1=C\CCC2=C[C@H](C3=C(C1)OC=C3C)OC2=O