2,5-Pyrrolidinedione, 1-[4-[(5-nitro-2-pyridinyl)dithio]-1-oxobutoxy]-


Chemical Name: 2,5-Pyrrolidinedione, 1-[4-[(5-nitro-2-pyridinyl)dithio]-1-oxobutoxy]-
CAS Number: 663598-85-4
Product Number: AG01FFM7(AGN-PC-0OFPTM)
Synonyms:
MDL No:
Molecular Formula: C13H13N3O6S2
Molecular Weight: 371.38882

Identification/Properties


Computed Properties
Molecular Weight:
371.382g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
8
Exact Mass:
371.025g/mol
Monoisotopic Mass:
371.025g/mol
Topological Polar Surface Area:
173A^2
Heavy Atom Count:
24
Formal Charge:
0
Complexity:
496
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:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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