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Homecas1820735-12-3

1820735-12-3

1820735-12-3 structural image
Product Name: hydrate methyl isoquinoline-3-carboxylate
Formula: C11H11NO3
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COMPUTED DESCRIPTORS

Molecular Weight 205.21 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 205.07389321 g/mol
Monoisotopic Mass 205.07389321 g/mol
Topological Polar Surface Area 40.2 Ų
Heavy Atom Count 15
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 2
Compound Is Canonicalized Yes