Benzenepropanoic acid, 4-methyl-3-pentenyl ester

Base Information

Chemical Name:Benzenepropanoic acid, 4-methyl-3-pentenyl ester
CAS No.:652161-21-2
Molecular Formula:C15H20O2
Molecular Weight:232.323
Hs Code.:
DSSTox Substance ID:DTXSID10465828

Synonyms:Benzenepropanoic acid, 4-methyl-3-pentenyl ester;652161-21-2;DTXSID10465828

Suppliers and Price of Benzenepropanoic acid, 4-methyl-3-pentenyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 1 raw suppliers

Chemical Property of Benzenepropanoic acid, 4-methyl-3-pentenyl ester

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:232.146329876
Heavy Atom Count:17
Complexity:246

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=CCCOC(=O)CCC1=CC=CC=C1)C

Technology Process of Benzenepropanoic acid, 4-methyl-3-pentenyl ester

There total 1 articles about Benzenepropanoic acid, 4-methyl-3-pentenyl ester which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 89.0%

: 763-89-3
4-methylpent-3-en-1-ol

: 645-45-4
hydrocinnamic acid chloride

: 652161-21-2
4-methyl-3-pentenyl hydrocinnamate

Guidance literature:: With pyridine; In dichloromethane; at 20 ℃; for 1h;
DOI:10.1021/jo034566s

Reference yield: 97.0%

: 652161-21-2
4-methyl-3-pentenyl hydrocinnamate

: 652161-22-3
3,4-epoxy-4-methylpentyl hydrocinnamate

Guidance literature:: With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 20 ℃; for 0.75h;
DOI:10.1021/jo034566s

Reference yield:

: 652161-21-2
4-methyl-3-pentenyl hydrocinnamate

: 652161-27-8
4-methyl-1,3,4-pentanetriyl 3-phenylorthopropionate

Guidance literature:: Multi-step reaction with 2 steps

1: 97 percent / m-CPBA / CH₂Cl₂ / 0.75 h / 20 °C

2: 93 percent / trifluoroacetic acid / CDCl₃

With 3-chloro-benzenecarboperoxoic acid; trifluoroacetic acid; In chloroform-d1; dichloromethane;
DOI:10.1021/jo034566s