77-83-8
Product Name:
Ethyl 3-methyl-3-phenylglycidate
Formula:
C12H14O3
Synonyms:
Ethyl 2,3-epoxy-3-phenylbutyrate;Ethyl 3-methyl-3-phenylglycidate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | 3-methyl-3-phenylglycidic acid ethyl ester is a clear, colorless to yellowish liquid with a strawberry-like odor. (NTP, 1992) |
|---|---|
| Color/Form | COLORLESS TO PALE-YELLOW LIQUID |
| Odor | ON DILUTION, STRONG FRUITY ODOR |
| Taste | CHARACTERISTIC SLIGHTLY ACID TASTE REMINISCENT OF STRAWBERRY |
| Boiling Point | 522 to 527 °F at 760 mmHg (NTP, 1992) |
| Flash Point | greater than 200 °F (NTP, 1992) |
| Solubility | Insoluble (<1 mg/ml at 68 °F) (NTP, 1992) |
| Density | 1.104 to 1.123 at 68 °F (NTP, 1992) |
| Refractive Index | INDEX OF REFRACTION: 1.5182 @ 20 °C |
| Kovats Retention Index | 1517 1517 |
| Other Experimental Properties | ACID VALUE: NOT MORE THAN 2 (0.9); KETONE CONTENT: 1% MAX (AS C8-H8-O) |
| Chemical Classes | Other Classes -> Esters, Other |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07  Environment GHS09 |
| GHS Hazard Statements |
H317:Sensitisation, Skin H411:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P272:Contaminated work clothing should not be allowed out of the workplace. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P333+P313:IF SKIN irritation or rash occurs: Get medical advice/attention. |
COMPUTED DESCRIPTORS
| Molecular Weight | 206.24 g/mol |
|---|---|
| XLogP3 | 1.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 4 |
| Exact Mass | 206.094294304 g/mol |
| Monoisotopic Mass | 206.094294304 g/mol |
| Topological Polar Surface Area | 38.8 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 245 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-methyl-3-phenylglycidic acid ethyl ester is a clear, colorless to yellowish liquid with a strawberry-like odor. (NTP, 1992)