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954239-52-2

954239-52-2 structural image
Product Name: 3-OXO-2,3-DIHYDRO-1H-ISOINDOLE-5-CARBOXYLIC ACID METHYL ESTER
Formula: C10H9NO3
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COMPUTED DESCRIPTORS

Molecular Weight 191.18 g/mol
XLogP3 0.6
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 191.058243149 g/mol
Monoisotopic Mass 191.058243149 g/mol
Topological Polar Surface Area 55.4 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 264
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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