1H-Pyrrole-2,5-dione, 1-(4-isocyanatophenyl)-


Chemical Name: 1H-Pyrrole-2,5-dione, 1-(4-isocyanatophenyl)-
CAS Number: 123457-83-0
Product Number: AG000KM4(AGN-PC-0JMLZ6)
Synonyms:
MDL No:
Molecular Formula: C11H6N2O3
Molecular Weight: 214.1769

Identification/Properties


Computed Properties
Molecular Weight:
214.18g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
214.038g/mol
Monoisotopic Mass:
214.038g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
370
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


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