8-(2-ethylhexylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one

Base Information

• Chemical Name: 8-(2-ethylhexylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
• CAS No.: 6492-98-4
• Molecular Formula: C15H24 N4 O S2
• Molecular Weight: 340.5073
• DSSTox Substance ID: DTXSID80401354
• Nikkaji Number: J3.070.537H
• NSC Number: 99680

Synonyms:NSC99680;6492-98-4;DTXSID80401354;NSC-99680

Chemical Property of 8-(2-ethylhexylsulfanyl)-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one

Chemical Property:

• Vapor Pressure: 1.49E-10mmHg at 25°C
• Boiling Point: 510.8°C at 760 mmHg
• Flash Point: 262.7°C
• Density: 1.26g/cm³
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 340.13915375
• Heavy Atom Count: 22
• Complexity: 420

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)CSC1=NC2=C(N1)C(=S)N(C(=O)N2C)C

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