nitrobenzylthioinosine 5'-monophosphate

Modify Date: 2025-10-03 18:10:15

nitrobenzylthioinosine 5'-monophosphate Structure
nitrobenzylthioinosine 5'-monophosphate structure
 Common Name nitrobenzylthioinosine 5'-monophosphate
CAS Number 65199-10-2 Molecular Weight 499.392
Density 1.9±0.1 g/cm3 Boiling Point 873.9±75.0 °C at 760 mmHg
Molecular Formula C17H18N5O9PS Melting Point N/A
MSDS N/A Flash Point 482.3±37.1 °C

 Names

Name 6-[(4-Nitrobenzyl)sulfanyl]-9-(5-O-phosphono-β-D-ribofuranosyl)-9H-purine
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.9±0.1 g/cm3
Boiling Point 873.9±75.0 °C at 760 mmHg
Molecular Formula C17H18N5O9PS
Molecular Weight 499.392
Flash Point 482.3±37.1 °C
Exact Mass 499.056274
LogP 2.01
Vapour Pressure 0.0±0.3 mmHg at 25°C
Index of Refraction 1.815
InChIKey RMYYPCIAJWYVHZ-LSCFUAHRSA-N
SMILES O=[N+]([O-])c1ccc(CSc2ncnc3c2ncn3C2OC(COP(=O)(O)O)C(O)C2O)cc1

 Synonyms

6-[(4-Nitrobenzyl)sulfanyl]-9-(5-O-phosphono-β-D-ribofuranosyl)-9H-purine
9H-Purine, 6-[[(4-nitrophenyl)methyl]thio]-9-(5-O-phosphono-β-D-ribofuranosyl)-
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