1,2-Benzenedicarbonitrile, 3,6-bis(acetyloxy)-


Chemical Name: 1,2-Benzenedicarbonitrile, 3,6-bis(acetyloxy)-
CAS Number: 83619-73-2
Product Number: AG00G3D6(AGN-PC-0JMNR0)
Synonyms:
MDL No: MFCD00036857
Molecular Formula: C12H8N2O4
Molecular Weight: 244.20292

Identification/Properties


Computed Properties
Molecular Weight:
244.206g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
4
Exact Mass:
244.048g/mol
Monoisotopic Mass:
244.048g/mol
Topological Polar Surface Area:
100A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
400
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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