Hexanoic acid, 2-(4-hydroxyphenyl)ethyl ester

Base Information

Chemical Name:Hexanoic acid, 2-(4-hydroxyphenyl)ethyl ester
CAS No.:491845-54-6
Molecular Formula:C14H20O3
Molecular Weight:236.311
Hs Code.:
DSSTox Substance ID:DTXSID80436161
Nikkaji Number:J2.430.392F
Wikidata:Q82251395
ChEMBL ID:CHEMBL3971754

Synonyms:Hexanoic acid, 2-(4-hydroxyphenyl)ethyl ester;491845-54-6;SCHEMBL9547798;CHEMBL3971754;DTXSID80436161;Hexanoic acid 4-hydroxyphenethyl ester

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

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Chemical Property of Hexanoic acid, 2-(4-hydroxyphenyl)ethyl ester

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:8
Exact Mass:236.14124450
Heavy Atom Count:17
Complexity:208

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC(=O)OCCC1=CC=C(C=C1)O

Technology Process of Hexanoic acid, 2-(4-hydroxyphenyl)ethyl ester

There total 1 articles about Hexanoic acid, 2-(4-hydroxyphenyl)ethyl 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:

: 3050-69-9
vinyl caproate

: 501-94-0
p-hydroxyphenethyl alcohol

: 491845-54-6
2-(4'-hydroxyphenyl)ethyl hexanoate

Guidance literature:: With Novozym 435; at 40 ℃; for 1h; Enzymatic reaction;
DOI:10.1021/jf1009928

Reference yield: 84.0%

: 491845-54-6
2-(4'-hydroxyphenyl)ethyl hexanoate

: 69039-02-7
2-(3,4-dihydroxyphenyl)ethyl acetate

Guidance literature:: 2-(4'-hydroxyphenyl)ethyl hexanoate; With 1-hydroxy-3H-benz[d][1,2]iodoxole-1,3-dione; In methanol; at 0 ℃; for 0.5h;

With sodium dithionite; In methanol; water; at 20 ℃; for 0.0833333h;
DOI:10.1021/jf801558z