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57980-74-2

57980-74-2 structural image
Product Name: 1,2,3,4-TETRAHYDRO-ISOQUINOLINE-3-CARBOXYLIC ACIDETHYL ESTER HYDROCHLORIDE
Formula: C12H16ClNO2
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COMPUTED DESCRIPTORS

Molecular Weight 241.71 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 241.0869564 g/mol
Monoisotopic Mass 241.0869564 g/mol
Topological Polar Surface Area 38.3 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 230
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes