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


Chemical Name: 1H-Isoindole-1,3(2H)-dione, 2-chloro-
CAS Number: 3481-09-2
Product Number: AG00I6VU(AGN-PC-0JKEF8)
Synonyms:
MDL No:
Molecular Formula: C8H4ClNO2
Molecular Weight: 181.5759

Identification/Properties


Computed Properties
Molecular Weight:
181.575g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
180.993g/mol
Monoisotopic Mass:
180.993g/mol
Topological Polar Surface Area:
37.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
217
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

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NMR Spectrum


Other Analytical Data


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