CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colourless liquid; Sweet floral aroma |
|---|---|
| Boiling Point | 225.00 to 226.00 °C. @ 760.00 mm Hg |
| Solubility | Practically insoluble or insoluble in water; soluble in ether |
| Density | 1.020-1.028 (20°) |
| Refractive Index | 1.448-1.494 |
| Kovats Retention Index | 1245 |
COMPUTED DESCRIPTORS
| Molecular Weight | 164.20 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 4 |
| Exact Mass | 164.083729621 g/mol |
| Monoisotopic Mass | 164.083729621 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 137 |
| 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
Phenyl butyrate is a member of phenols and a benzoate ester.