1-[6-(4-azido-2-nitroanilino)hexanoyloxy]-2,5-dioxopyrrolidine-3-sulfonic acid


Chemical Name: 1-[6-(4-azido-2-nitroanilino)hexanoyloxy]-2,5-dioxopyrrolidine-3-sulfonic acid
CAS Number: 102568-43-4
Product Number: AG0007Q6(AGN-PC-0KO7GC)
Synonyms:
MDL No:
Molecular Formula: C16H18N6O9S
Molecular Weight: 470.4139

Identification/Properties


Computed Properties
Molecular Weight:
470.413g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
12
Rotatable Bond Count:
11
Exact Mass:
470.086g/mol
Monoisotopic Mass:
470.086g/mol
Topological Polar Surface Area:
199A^2
Heavy Atom Count:
32
Formal Charge:
0
Complexity:
893
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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