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Technology Process of Theophylline, 8-(hexylthio)dithio-

Theophylline, 8-(hexylthio)dithio-

Base Information
  • Chemical Name:Theophylline, 8-(hexylthio)dithio-
  • CAS No.:6466-22-4
  • Molecular Formula:C13H20 N4 S3
  • Molecular Weight:328.5197
  • Hs Code.:2933990090
  • NSC Number:97990
  • UNII:WXI8VGV8GD
  • DSSTox Substance ID:DTXSID30214931
  • Nikkaji Number:J16.753C
  • Wikidata:Q83090855
  • Mol file:6466-22-4.mol
Theophylline, 8-(hexylthio)dithio-

Synonyms:Theophylline, 8-(hexylthio)dithio-;6466-22-4;Theophylline, 2,6-dithio-8-hexylthio-;2,6-Dithio-8-(N-hexylthio)theophylline;WXI8VGV8GD;NSC 97990;2,6-Dithio-8-n-hexylthiotheophylline;BRN 1140924;Theophylline, 2,6-dithio-(8-hexylthio)-;Uric acid, 1,3-dimethyl-2,6-dithio-8-hexylthio-;NSC-97990;8-(Hexylthio)-3,9-dihydro-1,3-dimethyl-1H-purine-2,6-dithione;NSC97990;UNII-WXI8VGV8GD;DTXSID30214931;C13H20N4S3;2,6-Dithio-8-hexylthiotheophylline;C13-H20-N4-S3;Theophylline,6-dithio-(8-hexylthio)-;LS-149531;Uric acid,3-dimethyl-2,6-dithio-(8-hexylthio)-;1H-PURINE-2,6-DITHIONE, 8-(HEXYLTHIO)-3,9-DIHYDRO-1,3-DIMETHYL-

Suppliers and Price of Theophylline, 8-(hexylthio)dithio-
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The product has achieved commercial mass production*data from LookChem market partment
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Chemical Property of Theophylline, 8-(hexylthio)dithio-
Chemical Property:
  • Vapor Pressure:3.06E-10mmHg at 25°C 
  • Melting Point:123-125 °C 
  • Boiling Point:502.9°Cat760mmHg 
  • PKA:6.15±0.20(Predicted) 
  • Flash Point:257.9°C 
  • PSA：128.02000 
  • Density:1.34g/cm3 
  • LogP:4.37130 
  • XLogP3:4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Rotatable Bond Count:6
  • Exact Mass:328.08501018
  • Heavy Atom Count:20
  • Complexity:377
Purity/Quality:
Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:CCCCCCSC1=NC2=C(N1)C(=S)N(C(=S)N2C)C
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