101-97-3
Product Name:
Ethyl phenylacetate
Formula:
C10H12O2
Synonyms:
Phenylacetic acid ethyl ester
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Liquid with a pleasant odor; [Merck Index] Clear colorless liquid; [Sigma-Aldrich MSDS] |
|---|---|
| Color/Form | Liquid |
| Odor | Sweet, honey odor |
| Taste | Taste characteristics at 10 ppm: sweet, fruity, honey, cocoa, apple and woody |
| Boiling Point | 228 °C |
| Melting Point | -29.4 °C |
| Flash Point | 210 °F (99 °F) |
| Solubility | In water, 1,478 mg/L at 25 °C |
| Density | 1.0333 g/cu cm at 20 °C |
| Vapor Density | 5.67 (Air = 1) |
| Vapor Pressure | 0.06 [mmHg] |
| LogP | log Kow = 2.28 |
| Stability/Shelf Life | Stable under recommended storage conditions. |
| Decomposition | When heated to decomposition it emits acrid smoke and irritating fumes. |
| Odor Threshold | Detection: 650 ppb |
| Refractive Index | Index of refraction: 1.4980 at 20 °C/D |
| Kovats Retention Index | 1210.8 1210.8 1211.7 1213 1209 1225 1224 1207.77 1205.65 1207.01 1208.64 1210.19 1211.83 1213.64 1215.5 1217.58 1219.66 1221.84 1224.16 1226.48 1239 1225 1229 1257 1260 1193 1217.8 1219 1246 1213 1213 1214 1219 1222 |
| Other Experimental Properties | Aroma threshold values: Detection: 650 ppb |
| Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| 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 | 164.20 g/mol |
|---|---|
| XLogP3 | 2.3 |
| 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
Ethyl phenylacetate is a member of benzenes.