9-octadecyl-3,9-dihydro-6H-purine-6-thione

Base Information

• Chemical Name: 9-octadecyl-3,9-dihydro-6H-purine-6-thione
• CAS No.: 82191-99-9
• Molecular Formula: C23H40N4S
• Molecular Weight: 404.6555
• NSC Number: 285123
• DSSTox Substance ID: DTXSID30397975

Synonyms:82191-99-9;NSC285123;DTXSID30397975;NSC-285123;9-octadecyl-3,9-dihydro-6H-purine-6-thione

Chemical Property of 9-octadecyl-3,9-dihydro-6H-purine-6-thione

Chemical Property:

• Vapor Pressure: 8.62E-13mmHg at 25°C
• Boiling Point: 565.1°C at 760 mmHg
• Flash Point: 295.6°C
• Density: 1.06g/cm³
• XLogP3: 8.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 17
• Exact Mass: 404.29736847
• Heavy Atom Count: 28
• Complexity: 440

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCN1C=NC2=C1NC=NC2=S

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