(22E,24R)-24,26-Dimethylcholesta-5,22,25(27)-trien-3beta-ol

Base Information

• Chemical Name: (22E,24R)-24,26-Dimethylcholesta-5,22,25(27)-trien-3beta-ol
• CAS No.: 80525-47-9
• Molecular Formula: C29H46O
• Molecular Weight: 410.67
• Wikidata: Q76386712
• Metabolomics Workbench ID: 34854
• Mol file: 80525-47-9.mol

Synonyms:(22E,24R)-24,26-dimethylcholesta-5,22,25(27)-trien-3beta-ol;DMC-TBO

Chemical Property of (22E,24R)-24,26-Dimethylcholesta-5,22,25(27)-trien-3beta-ol

Chemical Property:

• Vapor Pressure: 2.48E-12mmHg at 25°C
• Boiling Point: 505.4°C at 760 mmHg
• Flash Point: 219.9°C
• PSA: 20.23000
• Density: 0.99g/cm³
• LogP: 7.72090
• XLogP3: 8.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 410.354866087
• Heavy Atom Count: 30
• Complexity: 716

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(=C)C(C)C=CC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C
• Isomeric SMILES: CCC(=C)[C@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C