[[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;sodium


Chemical Name: [[3,4-dihydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate;sodium
CAS Number: 35908-31-7
Product Number: AG007D9X(AGN-PC-00URQR)
Synonyms:
MDL No:
Molecular Formula: C10H12N4Na3O14P3
Molecular Weight: 574.1113

Identification/Properties


Computed Properties
Molecular Weight:
574.111g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
16
Rotatable Bond Count:
8
Exact Mass:
573.926g/mol
Monoisotopic Mass:
573.926g/mol
Topological Polar Surface Area:
277A^2
Heavy Atom Count:
34
Formal Charge:
0
Complexity:
862
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
4
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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