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68959-28-4

68959-28-4 structural image
Product Name: JASMOLACTONE
Formula: C11H18O2
Synonyms: Petal pyranone
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description colourless liquid with a milky buttery odour
Boiling Point 140.00 °C. @ 1.00 mm Hg
Solubility insoluble in water; soluble in fat
Density 0.97-0.99
Refractive Index 1.473-1.480

COMPUTED DESCRIPTORS

Molecular Weight 182.26 g/mol
XLogP3 2.7
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 182.130679813 g/mol
Monoisotopic Mass 182.130679813 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 185
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

(Z)-6-(3-hexenyl)tetrahydro-2H-pyran-2-one is a 6-(3-hexenyl)tetrahydro-2H-pyran-2-one in which the double bond adopts a cis-configuration.