2-[(4-oxocyclohexyl)methyl]isoindole-1,3-dione


Chemical Name: 2-[(4-oxocyclohexyl)methyl]isoindole-1,3-dione
CAS Number: 423116-18-1
Product Number: AG00BZQH(AGN-PC-03SV25)
Synonyms:
MDL No:
Molecular Formula: C15H15NO3
Molecular Weight: 257.2845

Identification/Properties


Computed Properties
Molecular Weight:
257.289g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
257.105g/mol
Monoisotopic Mass:
257.105g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
384
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback