Product Name

  • Name

    6-THIOXANTHINE

  • EINECS 200-258-5
  • CAS No. 2002-59-7
  • Article Data4
  • CAS DataBase
  • Density 1.787 g/cm3
  • Solubility
  • Melting Point 300 °C
  • Formula C5H4N4OS
  • Boiling Point
  • Molecular Weight 168.179
  • Flash Point
  • Transport Information
  • Appearance light brown fine powder
  • Safety 24/25-36
  • Risk Codes 20/21/22
  • Molecular Structure Molecular Structure of 2002-59-7 (6-THIOXANTHINE)
  • Hazard Symbols HarmfulXn
  • Synonyms 2H-Purin-2-one,1,3,6,7-tetrahydro-6-thioxo- (9CI);Xanthine, 6-thio- (6CI,7CI,8CI);2-Hydroxy-6-mercaptopurine;2-Hydroxy-6-thiopurine;3,6-Dihydro-6-thioxo-9H-purine-2(1H)-one;6-Mercaptoxanthine;6-Thioxanthine;NSC 12160;
  • PSA 109.42000
  • LogP 0.30880

2-Hydroxy-6-mercaptopurine Chemical Properties

Product Name: 2-Hydroxy-6-mercaptopurine (CAS NO.2002-59-7)

Molecular Formula: C5H4N4OS
Molecular Weight: 168.18g/mol
Mol File: 2002-59-7.mol 
Melting Point: 300 °C
Density: 1.78 g/cm3
Index of Refraction: 1.799 
Molar Refractivity: 40.21 cm3 
Molar Volume: 94.1 cm3 
Surface Tension: 129.8 dyne/cm
XLogP3-AA: -0.1
H-Bond Donor: 3
H-Bond Acceptor: 2
Structure Descriptors of 2-Hydroxy-6-mercaptopurine (CAS NO.2002-59-7):
  IUPAC Name: 6-sulfanylidene-3,7-dihydropurin-2-one
  Canonical SMILES: C1=NC2=C(N1)C(=S)NC(=O)N2
  InChI: InChI=1S/C5H4N4OS/c10-5-8-3-2(4(11)9-5)6-1-7-3/h1H,(H3,6,7,8,9,10,11) 
  InChIKey: RJOXFJDOUQJOMQ-UHFFFAOYSA-N
Product Categories: Purines

2-Hydroxy-6-mercaptopurine Safety Profile

Safety Information of 2-Hydroxy-6-mercaptopurine (CAS NO.2002-59-7):
Hazard Codes: XnHarmful
Risk Statements: 20/21/22  
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.
Safety Statements: 24/25-36 
S24/25:Avoid contact with skin and eyes. 
S36:Wear suitable protective clothing.

2-Hydroxy-6-mercaptopurine Specification

 2-Hydroxy-6-mercaptopurine , its CAS NO. is 2002-59-7, the synonyms are 6-Thioxanthine ; -Purin-2-one, 1,3,6,7-tetrahydro-6-thioxo- .

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