5'-Inosinic acid,6-thio-, mono(4-nitrophenyl) ester (9CI)

Modify Date: 2025-10-03 10:17:29

5'-Inosinic acid,6-thio-, mono(4-nitrophenyl) ester (9CI) Structure
5'-Inosinic acid,6-thio-, mono(4-nitrophenyl) ester (9CI) structure
Common Name 5'-Inosinic acid,6-thio-, mono(4-nitrophenyl) ester (9CI)
CAS Number 15923-53-2 Molecular Weight 485.36500
Density 1.99g/cm3 Boiling Point 856ºC at 760mmHg
Molecular Formula C16H16N5O9PS Melting Point N/A
MSDS N/A Flash Point 471.5ºC

 Names

Name [3,4-dihydroxy-5-(6-sulfanylidene-3H-purin-9-yl)oxolan-2-yl]methyl (4-nitrophenyl) hydrogen phosphate

 Chemical & Physical Properties

Density 1.99g/cm3
Boiling Point 856ºC at 760mmHg
Molecular Formula C16H16N5O9PS
Molecular Weight 485.36500
Flash Point 471.5ºC
Exact Mass 485.04100
PSA 239.67000
LogP 1.73550
Vapour Pressure 3.31E-31mmHg at 25°C
Index of Refraction 1.825
InChIKey ZIZLCLUJBSYYLG-UHFFFAOYSA-N
SMILES O=[N+]([O-])c1ccc(OP(=O)(O)OCC2OC(n3cnc4c(=S)nc[nH]c43)C(O)C2O)cc1
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