Cholecalciferol sulfate

Base Information

• Chemical Name: Cholecalciferol sulfate
• CAS No.: 10529-43-8
• Molecular Formula: C27H44 O4 S
• Molecular Weight: 464.7

Synonyms:cholecalciferol sulfate;vitamin D3 sulfate;vitamin D3 sulfoconjugate

Chemical Property of Cholecalciferol sulfate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 71.98000
• Density: 1.1g/cm³
• LogP: 8.52690
• XLogP3: 7.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 464.29603105
• Heavy Atom Count: 32
• Complexity: 832

Purity/Quality:

98%,99%, ^*data from raw suppliers

CHOLECALCIFEROL SULFATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)CCCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)OS(=O)(=O)O)C
• Isomeric SMILES: C[C@H](CCCC(C)C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@@H](CCC3=C)OS(=O)(=O)O)C

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