Safrotin

Base Information

• Chemical Name: Safrotin
• CAS No.: 77491-30-6
• Molecular Formula: C10H20NO4PS•C4H7Cl2O4P
• Molecular Weight: 502.32
• Mol file: 77491-30-6.mol

Synonyms:safrotin

Chemical Property of Safrotin

Chemical Property:

• Vapor Pressure: 0.000304mmHg at 25°C
• Boiling Point: 321.1°C at 760 mmHg
• Flash Point: 148°C
• PSA: 153.26000
• LogP: 6.06070
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 12
• Exact Mass: 501.0309674
• Heavy Atom Count: 28
• Complexity: 511

Purity/Quality:

98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNP(=S)(OC)OC(=CC(=O)OC(C)C)C.COP(=O)(OC)OC=C(Cl)Cl
• Isomeric SMILES: CCNP(=S)(OC)O/C(=C/C(=O)OC(C)C)/C.COP(=O)(OC)OC=C(Cl)Cl