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17780-72-2

17780-72-2 structural image
Product Name: CLORGYLINE
Formula: C13H15Cl2NO
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1883

COMPUTED DESCRIPTORS

Molecular Weight 272.17 g/mol
XLogP3 4.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 271.0530695 g/mol
Monoisotopic Mass 271.0530695 g/mol
Topological Polar Surface Area 12.5 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 263
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

Clorgyline is an aromatic ether that is the 2,4-dichlorophenyl ether of 3-aminopropan-1-ol in which the nitrogen is substituted by a methyl group and a prop-1-yn-3-yl group. A monoamine oxidase inhibitor, it was formerly used as an antidepressant. It has a role as an EC 1.4.3.4 (monoamine oxidase) inhibitor and an antidepressant. It is a tertiary amino compound, a terminal acetylenic compound, an aromatic ether and a dichlorobenzene.