CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Liquid |
|---|---|
| Boiling Point | 252.00 °C. @ 760.00 mm Hg |
| Solubility | insoluble in water, soluble in alcohol and oils |
| Density | 0.886-0.892 (20°) |
| Refractive Index | 1.451-1.460 |
| Kovats Retention Index | 1582 |
COMPUTED DESCRIPTORS
| Molecular Weight | 252.39 g/mol |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 10 |
| Exact Mass | 252.208930132 g/mol |
| Monoisotopic Mass | 252.208930132 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 288 |
| 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
Linalyl hexanoate is a natural product found in Nelumbo lutea with data available.