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86-80-6

86-80-6 structural image
Product Name: quinisocaine
Formula: C17H24N2O
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 2030 2030

COMPUTED DESCRIPTORS

Molecular Weight 272.4 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 7
Exact Mass 272.188863393 g/mol
Monoisotopic Mass 272.188863393 g/mol
Topological Polar Surface Area 25.4 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 270
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

PRODUCT INTRODUCTION

description

2-[(3-butyl-1-isoquinolinyl)oxy]-N,N-dimethylethanamine is a member of isoquinolines.