CHEMICAL AND PHYSICAL PROPERTIES
| Boiling Point | 105.00 °C. @ 11.00 mm Hg |
|---|---|
| Kovats Retention Index | 1170 1176 1177 1172 1173 1169 1169 1169 1169 |
COMPUTED DESCRIPTORS
| Molecular Weight | 170.25 g/mol |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 7 |
| Exact Mass | 170.130679813 g/mol |
| Monoisotopic Mass | 170.130679813 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 139 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Ethyl 4-octenoate is a fatty acid ethyl ester of 4-octenoic acid. It has a role as a metabolite.