Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate

Basic Information

View in Editor

CAS Number

77-83-8

Molecular Formula

C12H14O3

Molecular Weight

206.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

86°C/0.4mmHg

Density

1.087

Flash Point

>110 ºC

Refractive Index

1.5045-1.5065

SMILES

View in Editor

CCOC(=O)C1OC1(C)c2ccccc2

InChI

InChI=1S/C12H14O3/c1-3-14-11(13)10-12(2,15-10)9-7-5-4-6-8-9/h4-8,10H,3H2,1-2H3

InChIKey

LQKRYVGRPXFFAV-UHFFFAOYSA-N

LogP

1.8637

Topological Polar Surface Area

38.83 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

245

Safety Information

View Safety Information

GHS Hazard Pictograms

H226

H315

H319

H335

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

3-Methyl-3-phenyl glycidic acid ethyl ester
ALDEHYDE C-16
ETHYL 2,3-EPOXY-3-PHENYLBUTYRATE
ETHYL 3-METHYL-2,3-EPOXY-HYDROCINAMIC ACID
ETHYL 3-METHYL-3-PHENYLGLYCIDATE
ETHYL 3-PHENYL-2,3-EPOXYBUTYRATE
ETHYL-A B-EPOXY-B-METHYLHYDROCINNAMATE
ETHYL BETA-METHYL-BETA-PHENYLGLYCIDATE
ETHYL METHYL PHENYL GLYCIDATE
FEMA 2444
GLYCIDIC ACID, 3-METHYL-3-PHENYL:ETHYL ESTER
STRAWBERRY ALDEHYDE
2,3-epoxy-3-phenyl-butanoicaciethylester
2,3-Epoxy-3-phenylbutyric acid, ethyl ester
3-methyl-3-phenyl-oxiranecarboxylicacid,ethylester
3-methyl-3-phenyl-oxiranecarboxylicaciethylester
alpha,beta-Epoxy-beta-methylhydrocinnamic acid, ethyl ester
alpha,beta-epoxy-beta-methyl-hydrocinnamicaciethylester
Ethyl 3-Methyl-3-phenylglycidate (mixture of isomers)
Ethyl 3-Methyl-3-phenylglycidate (Mixture of cis and trans)
2,3-Epoxy-3-phenylbutyric Acid Ethyl Ester (mixture of isomers)
Ethyl 2,3-Epoxy-3-phenylbutyrate (mixture of isomers)
3-Methyl-3-phenylglycidic Acid Ethyl Ester (mixture of isomers)
ETHYL METHYLPHENYLGLYCIDATE
Fraeseol
EMPG
ethyl 3-methyl-3-phenyloxirane-2-carboxylate
Ethyl(methylphenyl)glycidate
Ethyl-3-methyl-3-phenylglycidate
cis-Ethyl 3-methyl-3-phenylglycidate
3-Methyl-3-phenylglycidic acid ethyl ester

MDL Number

MFCD00022338

Customs Code

2918990090

FAQ

What is Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate (CAS: 77-83-8)?

Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate is an organic compound with the chemical formula C12H14O3. It is a cyclic ester characterized by an oxirane ring (epoxide) linked to a carboxylate group. This compound is known for its reactivity and is used in various chemical processes due to its unique structure and functional groups.

What are the main uses of Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate (CAS: 77-83-8)?

Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in organic synthesis, polymer chemistry, and as an intermediate in the production of fine chemicals. Its utility stems from its ability to participate in ring-opening reactions and form various derivatives.

Is Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate (CAS: 77-83-8) safe?

Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate is generally considered safe when handled properly. However, as a reactive chemical, it requires careful handling to avoid exposure. Safety standards recommend using appropriate personal protective equipment (PPE) and working in well-ventilated areas. It is not classified as highly toxic but should be treated with caution during use.

How should Ethyl 3-methyl-3-phenyl-2-oxiranecarboxylate (CAS: 77-83-8) be stored?

This compound should be stored in a cool, dry, and dark place, ideally at 2-8°C. It is sensitive to moisture and should be kept in a sealed container to prevent degradation. Avoid exposure to air and light to maintain stability. Proper storage ensures the compound remains chemically intact and safe for use in research or industrial applications.