CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Yellow to pale reddish-brown liquid with an aromatic odor; Affected slowly by light; [Hawley] |
|---|---|
| Color/Form | Yellow to pale reddish-brown liquid |
| Odor | Aromatic odor |
| Boiling Point | 256-270 °C @ 760 mm Hg |
| Solubility | Practically insol in water; miscible with alcohol, chloroform, ether, glacial acetic acid |
| Density | 1.052-1.060 @ 25 °C/25 °C |
| Stability/Shelf Life | REASONABLY STABLE IN AIR BUT SLOWLY AFFECTED BY LIGHT |
| Decomposition | When heated to decomposition it emits acrid fumes. |
| Refractive Index | Index of refraction: 1.4745-1.4755 @ 25 °C/D |
| Kovats Retention Index | 1590.4 |
| Other Experimental Properties | Exists largely as the dihydropyrone in equilibrium with the open chain enol form |
| Chemical Classes | Pesticides -> Insect Repellents |
COMPUTED DESCRIPTORS
| Molecular Weight | 226.27 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 5 |
| Exact Mass | 226.12050905 g/mol |
| Monoisotopic Mass | 226.12050905 g/mol |
| Topological Polar Surface Area | 52.6 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 315 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Butopyronoxyl is a member of pyrans and a carbonyl compound.