6-Thioxo-6,9-dihydro-1H-purin-2(3H)-one

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Names

[ CAS No. ]:
2002-59-7

[ Name ]:
6-Thioxo-6,9-dihydro-1H-purin-2(3H)-one

[Synonym ]:
6-Sulfanyl-9H-purin-2-ol
6-Thioxo-6,9-dihydro-1H-purin-2(3H)-one
MFCD00010841
6-Thioxo-1,3,6,7-tetrahydro-2H-purin-2-one
7H-Purin-2-ol, 6-mercapto-
9H-purin-2-ol, 6-mercapto-
6-sulfanylidene-3,7-dihydropurin-2-one

Chemical & Physical Properties

[ Density]:
1.8±0.1 g/cm3

[ Boiling Point ]:
722.6±63.0 °C at 760 mmHg

[ Melting Point ]:
300 °C

[ Molecular Formula ]:
C5H4N4OS

[ Molecular Weight ]:
168.176

[ Flash Point ]:
390.8±33.7 °C

[ Exact Mass ]:
168.010574

[ PSA ]:
109.42000

[ LogP ]:
-0.70

[ Vapour Pressure ]:
0.0±2.4 mmHg at 25°C

[ Index of Refraction ]:
1.894

[ Storage condition ]:
2-8°C

Safety Information

[ Hazard Codes ]:
Xn: Harmful;

[ Risk Phrases ]:
R20/21/22

[ Safety Phrases ]:
S24/25-S36

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • 6,7-Dihydro-1,3-dimethyl-8-[(piperidin-3-yl)methylthio]-6-thioxo-1H-purin-2(3H)-one
  • N-(8-Bromo-6-oxo-6,9-dihydro-1H-purin-2-yl)pivalamide
  • N-(9-(5-(hydroxymethyl)tetrahydrofuran-2-yl)-6-oxo-6,9-dihydro-1H-purin-2-yl)isobutyramide
  • N2-isobutyryl acyclovir
  • N-(9-(((1-(benzyloxy)-3-chloropropan-2-yl)oxy)methyl)-6-oxo-6,9-dihydro-1H-purin-2-yl)acetamide
  • N-(9-((3S,4R,5S)-5-((BIS(4-METHOXYPHENYL)(PHENYL)METHOXY)METHYL)-4-HYDROXYTETRAHYDROFURAN-3-YL)-6-OXO-6,9-DIHYDRO-1H-PURIN-2-YL)PROPIONAMIDE
  • 2-{4-[6-Methyl-2-(morpholin-4-yl)pyrimidin-4-yl]piperazin-1-yl}-1-(piperidin-1-yl)ethan-1-one
  • 1-(Azepan-1-yl)-2-{4-[6-(morpholin-4-yl)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
  • 1-(Azepan-1-yl)-2-{4-[6-(morpholin-4-yl)pyridazin-3-yl]piperazin-1-yl}ethan-1-one
  • 1-(4-Methylpiperidin-1-yl)-2-{4-[6-(morpholin-4-yl)pyridazin-3-yl]piperazin-1-yl}ethan-1-one
  • 4-{[1-(1-Benzylpiperidin-4-yl)azetidin-3-yl]oxy}pyridine
  • 4-(2-{4-[(2,4-Dimethylphenyl)methyl]piperazin-1-yl}pyrimidin-4-yl)morpholine
  • 4-(4-{4-[(2,4-Dimethylphenyl)methyl]piperazin-1-yl}pyrimidin-2-yl)morpholine
  • 1-(Azepan-1-yl)-2-{4-[2-(ethylamino)pyrimidin-4-yl]piperazin-1-yl}ethan-1-one
  • 4-(3-{[(5-Bromopyrimidin-2-yl)oxy]methyl}piperidin-1-yl)-6-methoxypyrimidine
  • 6-{1-[(2-Chloro-4-fluorophenyl)methyl]-octahydropyrrolo[2,3-c]pyrrol-5-yl}pyridine-3-carbonitrile