Riboflavin 5'-(trihydrogen diphosphate), 6-hydroxy-, P'-->5' ester with adenosine

Base Information

• Chemical Name: Riboflavin 5'-(trihydrogen diphosphate), 6-hydroxy-, P'-->5' ester with adenosine
• CAS No.: 52301-43-6
• Molecular Formula: C27H33 N9 O16 P2
• Molecular Weight: 801.55
• DSSTox Substance ID: DTXSID701136827
• Mol file: 52301-43-6.mol

Synonyms:DTXSID701136827;PD042351;Riboflavin 5'-(trihydrogen diphosphate), 6-hydroxy-, P'-->5' ester with adenosine

Chemical Property of Riboflavin 5'-(trihydrogen diphosphate), 6-hydroxy-, P'-->5' ester with adenosine

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 402.78000
• Density: 2.14g/cm³
• LogP: -2.08880
• XLogP3: -6.4
• Hydrogen Bond Donor Count: 10
• Hydrogen Bond Acceptor Count: 22
• Rotatable Bond Count: 13
• Exact Mass: 801.15204999
• Heavy Atom Count: 54
• Complexity: 1790

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)C2=NC3=C(NC(=O)NC3=O)N(C2=C1)CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O)C