2-(1,3-Dioxoisoindolin-2-yl);-3-methylbutanoic acid


Chemical Name: 2-(1,3-Dioxoisoindolin-2-yl);-3-methylbutanoic acid
CAS Number: 5115-65-1
Product Number: AG00DAPK(AGN-PC-0WBKB1)
Synonyms:
MDL No: MFCD00043587
Molecular Formula:
Molecular Weight:

Identification/Properties


Computed Properties
Molecular Weight:
247.25g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
247.084g/mol
Monoisotopic Mass:
247.084g/mol
Topological Polar Surface Area:
74.7A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
367
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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