CAS 39495-82-4

ethyl 5-methylhex-5-enoate

Description:

Ethyl 5-methylhex-5-enoate is an organic compound classified as an ester, characterized by the presence of both an alkene and an ester functional group. Its molecular structure features a six-carbon chain with a double bond located at the fifth carbon, along with a methyl group at the same position, contributing to its unsaturation. The ethyl group attached to the ester functional group enhances its volatility and solubility in organic solvents. This compound is typically colorless to pale yellow and has a pleasant, fruity odor, which is common among esters. Ethyl 5-methylhex-5-enoate is used in various applications, including as a flavoring agent and in the synthesis of other organic compounds. Its reactivity is influenced by the double bond, making it susceptible to addition reactions, which can be exploited in synthetic organic chemistry. Safety data should be consulted for handling, as with all chemical substances, to ensure proper precautions are taken.

Formula: C₉H₁₆O₂

InChI: InChI=1/C9H16O2/c1-4-11-9(10)7-5-6-8(2)3/h2,4-7H2,1,3H3

SMILES: CCOC(=O)CCCC(=C)C

Synonyms:

• 5-Hexenoic acid, 5-methyl-, ethyl ester
• Ethyl 5-methyl-5-hexenoate
• 5-Methyl-5-hexenoic acid ethyl ester
• Ethyl5-methylhex-5-enoate97%

ETHYL 5-METHYL-5-HEXENOATE

CAS: 39495-82-4

Formula: C₉H₁₆O₂

Purity: 95%

Color and Shape: Solid

Molecular weight: 156.2221

Ref: IN-DA00C7Q6

Ethyl 5-methylhex-5-enoat

CAS: 39495-82-4

Ethyl 5-methylhex-5-enoate can be prepared from ethyl acrylate and isobutylene.

Formula: C₉H₁₆O₂

Purity: 98.74%

Color and Shape: Solid

Molecular weight: 156.22

Ref: TM-T84004

Ethyl 5-methylhex-5-enoat

CAS: 39495-82-4

Ethyl 5-methylhex-5-enoat

Formula: C₉H₁₆O₂

Purity: ≥98%

Molecular weight: 156.22

Ref: 54-BUP11413

Ethyl 5-methylhex-5-enoate

CAS: 39495-82-4

Ethyl 5-methylhex-5-enoate

Formula: C₉H₁₆O₂

Purity: 97%

Color and Shape: Colourless Liquid-Oil

Molecular weight: 156.22214

Ref: 54-OR01824

Ethyl 5-Methyl-5-hexenoate

Controlled Product

CAS: 39495-82-4

Applications Ethyl 5-Methyl-5-hexenoate is used in preparation of Isoxazoline compounds. It is also, used in activation of primary and secondary Benzylic and tertiary alkyl (sp3)C-F bonds inside a self-assembled molecular container.
References Yang, J., et al.: Fami. Zhuan. Shenq., (2020); Koster, Jesper M., et a.: Front. in Chem., 6, 639 (2018);

Formula: C₉H₁₆O₂

Color and Shape: Neat

Molecular weight: 156.222

Ref: TR-E824495