CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless liquid with an odor like orange blossom or jasmine; [Acros Organics MSDS] |
|---|---|
| Boiling Point | 206.00 to 211.00 °C. @ 760.00 mm Hg |
| Melting Point | -38.5 °C |
| Solubility | miscible with alcohol, most fixed oils, organic solvents; insoluble in water |
| Density | 0.865-0.868 |
| Vapor Pressure | 0.4 [mmHg] |
| Refractive Index | 1.418-1.421 |
| Kovats Retention Index | 1185 1191 1189 1211 1191 1189 1195 1191 1193 1195 1196 1196 1196 1196 1196 1196 1197 1197 1197 1197 1197 1199 1199 1190 1193 1192 1196 1194 1194 1190.56 1193 1193 1192 1191.9 1195 1195 1196 1196 1196 1197 1195 1196 1194 1199 1178 1188 1189 1190 1194 1191 1194 1195 1189.4 1198 1187 1188 1184 1188 1188 1189 1191 1193 1193 1204 1190 1193 1193 1193.3 1190 1197 1190 1193 1197 1192 1194 1199 1192 1193 1193 1190 1193 1193 1193 1193 1198 1210 1194 1193.4 1200 |
| Chemical Classes | Solvents -> Esters (<C12) |
SAFETY INFORMATION
| Signal word | Danger |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Health Hazard GHS08  Environment GHS09 |
| GHS Hazard Statements |
H227:Flammable liquids H303:Acute toxicity,oral |
| Precautionary Statement Codes |
P403+P235:Store in a well-ventilated place. Keep cool. |
COMPUTED DESCRIPTORS
| Molecular Weight | 172.26 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 172.146329876 g/mol |
| Monoisotopic Mass | 172.146329876 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 110 |
| 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
Octyl acetate is the acetate ester of octan-1-ol. It has a role as a plant metabolite. It is functionally related to an octan-1-ol.