6-Thiocyanato-fad

Base Information

• Chemical Name: 6-Thiocyanato-fad
• CAS No.: 101760-87-6
• Molecular Formula: C28H32 N10 O15 P2 S
• Molecular Weight: 842.624202
• Mol file: 101760-87-6.mol

Synonyms:6-SCN-FAD;6-thiocyanato-FAD

Chemical Property of 6-Thiocyanato-fad

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 431.64000
• Density: 2.08g/cm³
• LogP: -1.22122
• XLogP3: -4.4
• Hydrogen Bond Donor Count: 9
• Hydrogen Bond Acceptor Count: 22
• Rotatable Bond Count: 14
• Exact Mass: 842.12445552
• Heavy Atom Count: 56
• Complexity: 1730

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C(=C1C)SC#N)N=C3C(=O)NC(=O)N=C3N2CC(C(C(COP(=O)(O)OP(=O)(O)OCC4C(C(C(O4)N5C=NC6=C(N=CN=C65)N)O)O)O)O)O