Ethanedioic acid, bis(2,4-dinitrophenyl) ester


Chemical Name: Ethanedioic acid, bis(2,4-dinitrophenyl) ester
CAS Number: 16536-30-4
Product Number: AG001W3O(AGN-PC-0KOYWT)
Synonyms:
MDL No:
Molecular Formula: C14H6N4O12
Molecular Weight: 422.2170

Identification/Properties


Computed Properties
Molecular Weight:
422.218g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
12
Rotatable Bond Count:
5
Exact Mass:
421.998g/mol
Monoisotopic Mass:
421.998g/mol
Topological Polar Surface Area:
236A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
673
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

Safety Information


NMR Spectrum


Other Analytical Data


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