9-dodecyl-3H-purine-6-thione

Base Information

• Chemical Name: 9-dodecyl-3H-purine-6-thione
• CAS No.: 82191-96-6
• Molecular Formula: C17H28N4S
• Molecular Weight: 320.496
• NSC Number: 285127
• DSSTox Substance ID: DTXSID40391489
• Mol file: 82191-96-6.mol

Synonyms:NSC285127;82191-96-6;DTXSID40391489;NSC-285127

Chemical Property of 9-dodecyl-3H-purine-6-thione

Chemical Property:

• Vapor Pressure: 3.36E-10mmHg at 25°C
• Boiling Point: 501.8°Cat760mmHg
• Flash Point: 257.3°C
• Density: 1.13g/cm³
• XLogP3: 5.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 11
• Exact Mass: 320.20346808
• Heavy Atom Count: 22
• Complexity: 359

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCN1C=NC2=C1NC=NC2=S