CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless liquid; Warm, herbaceous, slightly earthy-green aroma |
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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 |
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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.