8-(Ethylthio)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dithione

Base Information

• Chemical Name: 8-(Ethylthio)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dithione
• CAS No.: 6508-29-8
• Molecular Formula: C9H12N4S3
• Molecular Weight: 272.4134
• NSC Number: 95866
• UNII: 2O2EG1ML3X
• DSSTox Substance ID: DTXSID30215387
• Wikidata: Q83091432

Synonyms:6508-29-8;2O2EG1ML3X;8-(Ethylthio)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dithione;NSC95866;NSC 95866;UNII-2O2EG1ML3X;NSC-95866;NCIOpen2_006098;DTXSID30215387;THEOPHYLLINE, 8-(ETHYLTHIO)DITHIO-;8-ethylsulfanyl-1,3-dimethyl-9H-purine-2,6-dithione;1H-PURINE-2,6-DITHIONE, 8-(ETHYLTHIO)-3,9-DIHYDRO-1,3-DIMETHYL-;8-(ETHYLTHIO)-3,9-DIHYDRO-1,3-DIMETHYL-1H-PURINE-2,6-DITHIONE

Chemical Property of 8-(Ethylthio)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dithione

Chemical Property:

• Vapor Pressure: 5.34E-09mmHg at 25°C
• Boiling Point: 469.8°Cat760mmHg
• Flash Point: 237.9°C
• Density: 1.52g/cm³
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 272.02240992
• Heavy Atom Count: 16
• Complexity: 322

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCSC1=NC2=C(N1)C(=S)N(C(=S)N2C)C

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