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90-84-6

90-84-6 structural image
Product Name: DIETHYLPROPION
Formula: C13H19NO
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Melting Point 168
Solubility White or creamy white, small crystals or crystalline powder; characteristic, mildly aromatic odor; 1 g sol in: about 0.6 mL water, about 0.6 ml chloroform, 1 ml absolute methanol, 1 ml alcohol; practically insoluble in ether /Diethylpropion hydrochloride/
LogP 2.8
Stability/Shelf Life Stable in dry air /Diethylpropion hydrochloride/
Decomposition When heated to decomp it emits very toxic fumes of /hydrogen chloride and nitrogen oxides./ /Diethylpropion hydrochloride/
Collision Cross Section 148 Ų [M+H]+ [CCS Type: TW, Method: Major Mix IMS/Tof Calibration Kit (Waters)]
Kovats Retention Index 1483 1470 1495 1476 1489 1490 1480 1492.6 1493.1 1490.9 1499.4 1470 1480 1483 1470 1465 1475 1486 1485
Other Experimental Properties Crystals; dec 168 °C /Hydrochloride/

COMPUTED DESCRIPTORS

Molecular Weight 205.30 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 5
Exact Mass 205.146664230 g/mol
Monoisotopic Mass 205.146664230 g/mol
Topological Polar Surface Area 20.3 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 193
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 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Diethylpropion is an aromatic ketone that is propiophenone in which one of the hydrogens alpha- to the carbonyl is substituted by a diethylamino group. A central stimulant and indirect-acting sympathomimetic, it is an appetite depressant and is used as the hydrochloride as an anoretic in the short term management of obesity. It has a role as an appetite depressant. It is a tertiary amine and an aromatic ketone. It is functionally related to a propiophenone.