8-Thiocyanatoriboflavin

Base Information

• Chemical Name: 8-Thiocyanatoriboflavin
• CAS No.: 130574-30-0
• Molecular Formula: C17H17 N5 O6 S
• Molecular Weight: 419.41178
• DSSTox Substance ID: DTXSID30926805
• Mol file: 130574-30-0.mol

Synonyms:8-thiocyanatoriboflavin

Chemical Property of 8-Thiocyanatoriboflavin

Chemical Property:

• PSA: 210.91000
• Density: 1.75g/cm³
• LogP: -0.99812
• XLogP3: -1.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 6
• Exact Mass: 419.08995445
• Heavy Atom Count: 29
• Complexity: 794

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1SC#N)N(C3=NC(=O)NC(=O)C3=N2)CC(C(C(CO)O)O)O