Lupeol palmitate

Base Information

• Chemical Name: Lupeol palmitate
• CAS No.: 32214-80-5
• Molecular Formula: C46H80 O2
• Molecular Weight: 665.13
• DSSTox Substance ID: DTXSID20954056
• Nikkaji Number: J460.653A
• Wikidata: Q82933075
• Mol file: 32214-80-5.mol

Synonyms:lupenyl palmitate

Chemical Property of Lupeol palmitate

Chemical Property:

• Vapor Pressure: 2.89E-17mmHg at 25°C
• Melting Point: 110℃
• Boiling Point: 659.5°Cat760mmHg
• Flash Point: 352.9°C
• PSA: 26.30000
• Density: 0.96g/cm³
• LogP: 14.05700
• XLogP3: 17.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 17
• Exact Mass: 664.61583179
• Heavy Atom Count: 48
• Complexity: 1090

Purity/Quality:

≥98% ^*data from raw suppliers

Lupeolpalmitate 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC(=O)OC1CCC2(C3CCC4C5C(CCC5(CCC4(C3(CCC2C1(C)C)C)C)C)C(=C)C)C
• Isomeric SMILES: CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@@H]4[C@H]5[C@@H](CC[C@@]5(CC[C@]4([C@@]3(CC[C@H]2C1(C)C)C)C)C)C(=C)C)C