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76-50-6

76-50-6 structural image
Product Name: Bornyl isovalerate
Formula: C15H26O2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Colourless liquid; Warm, herbaceous, slightly earthy-green aroma
Solubility Soluble in oils, Insoluble in water
Density 0.944-0.947
Refractive Index 1.458-1.461
Kovats Retention Index 1494 1494

COMPUTED DESCRIPTORS

Molecular Weight 238.37 g/mol
XLogP3 4.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 4
Exact Mass 238.193280068 g/mol
Monoisotopic Mass 238.193280068 g/mol
Topological Polar Surface Area 26.3 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 319
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 3
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Isobornyl isovalerate is a natural product found in Artemisia salsoloides with data available.