1H-Isoindol-1-one, 7-bromo-2,3-dihydro-


Chemical Name: 1H-Isoindol-1-one, 7-bromo-2,3-dihydro-
CAS Number: 200049-46-3
Product Number: AG0074DT(AGN-PC-00OV0X)
Synonyms:
MDL No:
Molecular Formula: C8H6BrNO
Molecular Weight: 212.0433

Identification/Properties


Computed Properties
Molecular Weight:
212.046g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
210.963g/mol
Monoisotopic Mass:
210.963g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
183
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


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