1H-Isoindole-1,3(2H)-dione, 2-(2-chloroethyl)-


Chemical Name: 1H-Isoindole-1,3(2H)-dione, 2-(2-chloroethyl)-
CAS Number: 6270-06-0
Product Number: AG003ERB(AGN-PC-0D04J4)
Synonyms:
MDL No:
Molecular Formula: C10H8ClNO2
Molecular Weight: 209.6290

Identification/Properties


Properties
MP:
82-84 °C(lit.)
BP:
328.2°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
209.629g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
209.024g/mol
Monoisotopic Mass:
209.024g/mol
Topological Polar Surface Area:
37.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
243
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-(2-Chloroethyl)isoindoline-1,3-dione, a versatile compound in chemical synthesis due to its ability to undergo nucleophilic substitution reactions. This compound serves as a key intermediate in the synthesis of various organic molecules, particularly those used in pharmaceuticals and agrochemicals. Its reactivity allows for the introduction of different functional groups, enabling the creation of diverse chemical structures with tailored properties. In organic synthesis, 2-(2-Chloroethyl)isoindoline-1,3-dione plays a crucial role in building complex molecular frameworks and is a valuable tool for chemists seeking to design novel compounds with specific properties and applications.