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1322-58-3

1322-58-3 structural image
Product Name: 3,4,5,6-TETRAHYDROPSEUDOIONONE
Formula: C13H24O
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Pale straw yellow or colourless oily liquid; sweet floral balsamic odour with a rose to woody quality
Boiling Point 234.00 °C. @ 760.00 mm Hg
Solubility insoluble in water; soluble in oils
Density 0.865-0.875
Refractive Index 1.449-1.455
Kovats Retention Index 1329 1424

COMPUTED DESCRIPTORS

Molecular Weight 196.33 g/mol
XLogP3 4.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 7
Exact Mass 196.182715385 g/mol
Monoisotopic Mass 196.182715385 g/mol
Topological Polar Surface Area 17.1 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 187
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

6,10-Dimethylundec-9-en-2-one is a monoterpenoid.