3-(10-Pyrenedecanoyl)cholesterol

Base Information

• Chemical Name: 3-(10-Pyrenedecanoyl)cholesterol
• CAS No.: 97850-83-4
• Molecular Formula: C53H72 O2
• Molecular Weight: 741.16
• DSSTox Substance ID: DTXSID30913619
• Nikkaji Number: J849.846F
• Wikidata: Q82884269
• Mol file: 97850-83-4.mol

Synonyms:3-(10-pyrenedecanoyl)cholesterol;P-10-cholesterol

Chemical Property of 3-(10-Pyrenedecanoyl)cholesterol

Chemical Property:

• Vapor Pressure: 1.62E-24mmHg at 25°C
• Boiling Point: 783.7°C at 760 mmHg
• Flash Point: 430.6°C
• Density: 1.07g/cm³
• XLogP3: 17.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 17
• Exact Mass: 740.55323154
• Heavy Atom Count: 55
• Complexity: 1300

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)CCCCCCCCCC5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)C)C
• Isomeric SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)CCCCCCCCCC5=C6C=CC7=CC=CC8=C7C6=C(C=C8)C=C5)C)C