1,24,25,26-Tetrahydroxyergocalciferol

Base Information

• Chemical Name: 1,24,25,26-Tetrahydroxyergocalciferol
• CAS No.: 103305-11-9
• Molecular Formula: C28H44 O5
• Molecular Weight: 0
• Mol file: 103305-11-9.mol

Synonyms:1,24,25,26-tetrahydroxyergocalciferol;1,24,25,26-tetrahydroxyvitamin D2

Chemical Property of 1,24,25,26-Tetrahydroxyergocalciferol

Chemical Property:

• Vapor Pressure: 5.94E-20mmHg at 25°C
• Boiling Point: 655.3°Cat760mmHg
• Flash Point: 278.1°C
• PSA: 101.15000
• Density: 1.16g/cm³
• LogP: 3.81400
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 460.31887450
• Heavy Atom Count: 33
• Complexity: 828

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C=CC(C)(C(C)(CO)O)O)C1CCC2C1(CCCC2=CC=C3CC(CC(C3=C)O)O)C
• Isomeric SMILES: C[C@H](/C=C/[C@](C)(C(C)(CO)O)O)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C/C=C\3/C[C@H](C[C@@H](C3=C)O)O)C