CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Liquid; [Alfa Aesar MSDS] |
|---|---|
| Solubility | insoluble in water; soluble in organic solvents, oils |
| Density | 1.154-1.160 |
| Refractive Index | 1.506-1.513 |
| Chemical Classes | Other Uses -> Food Additives |
COMPUTED DESCRIPTORS
| Molecular Weight | 222.24 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 222.08920892 g/mol |
| Monoisotopic Mass | 222.08920892 g/mol |
| Topological Polar Surface Area | 44.8 Ų |
| Heavy Atom Count | 16 |
| Formal Charge | 0 |
| Complexity | 251 |
| 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
Piperonyl isobutyrate is a member of benzodioxoles.