CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Clear colourless or pale yellow liquid; Coconut, fruity aroma |
|---|---|
| Solubility | Sparingly soluble in water; soluble in many non-polar solvents |
| Density | 0.840-0.844 |
| Refractive Index | 1.442-1.448 |
| Chemical Classes | Other Classes -> Aliphatic Ketones, Other |
COMPUTED DESCRIPTORS
| Molecular Weight | 126.20 g/mol |
|---|---|
| XLogP3 | 2.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 126.104465066 g/mol |
| Monoisotopic Mass | 126.104465066 g/mol |
| Topological Polar Surface Area | 17.1 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 103 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Methylheptenone is an enone.