(22E)-Ergosta-7,22-dien-3-ol

Base Information

• Chemical Name: (22E)-Ergosta-7,22-dien-3-ol
• CAS No.: 96391-64-9
• Molecular Formula: C₂₈H₄₆O
• Molecular Weight: 398.673
• Mol file: 96391-64-9.mol

Synonyms:ergosta-7,22-dien-3-ol;ergosta-7,22-dien-3-ol, (3beta,22E)-isomer;ergosta-7,22-dien-3-ol, (3beta,5alpha,6alpha,22E)-isomer

Chemical Property of (22E)-Ergosta-7,22-dien-3-ol

Chemical Property:

• Vapor Pressure: 1.5E-11mmHg at 25°C
• Boiling Point: 487.5°Cat760mmHg
• Flash Point: 213°C
• Density: 0.99g/cm³
• XLogP3: 7.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 398.354866087
• Heavy Atom Count: 29
• Complexity: 659

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)C(C)C=CC(C)C1CCC2C1(CCC3C2=CCC4C3(CCC(C4)O)C)C
• Isomeric SMILES: C[C@H](/C=C/[C@H](C)C(C)C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CCC4[C@@]3(CCC(C4)O)C)C