tetrasodium;3-[(2E)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonatooxymethyl)pyridin-2-ylidene]hydrazinyl]-7-nitronaphthalene-1,5-disulfonate


Chemical Name: tetrasodium;3-[(2E)-2-[4-formyl-6-methyl-5-oxo-3-(phosphonatooxymethyl)pyridin-2-ylidene]hydrazinyl]-7-nitronaphthalene-1,5-disulfonate
CAS Number: 1021868-77-8
Product Number: AG008Y3Z(AGN-PC-07A7QZ)
Synonyms:
MDL No: MFCD03093192
Molecular Formula: C18H11N4Na4O14PS2
Molecular Weight: 694.3612

Identification/Properties


Computed Properties
Molecular Weight:
694.353g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
17
Rotatable Bond Count:
5
Exact Mass:
693.904g/mol
Monoisotopic Mass:
693.904g/mol
Topological Polar Surface Area:
324A^2
Heavy Atom Count:
43
Formal Charge:
0
Complexity:
1170
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
5
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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