2-[3-(1-Hydroxy-pentyl)phenoxymethyl]benzoic acid methyl ester

Base Information

Chemical Name:2-[3-(1-Hydroxy-pentyl)phenoxymethyl]benzoic acid methyl ester
CAS No.:92532-05-3
Molecular Formula:C20H24O4
Molecular Weight:328.408
Hs Code.:
ChEMBL ID:CHEMBL8714
DSSTox Substance ID:DTXSID80543869

Synonyms:92532-05-3;2-[3-(1-hydroxy-pentyl)phenoxymethyl]benzoic acid methyl ester;CHEMBL8714;SCHEMBL10360012;DTXSID80543869;Methyl 2-{[3-(1-hydroxypentyl)phenoxy]methyl}benzoate

Suppliers and Price of 2-[3-(1-Hydroxy-pentyl)phenoxymethyl]benzoic acid methyl ester

Supply Marketing:

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

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Chemical Property of 2-[3-(1-Hydroxy-pentyl)phenoxymethyl]benzoic acid methyl ester

Chemical Property:

XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:9
Exact Mass:328.16745924
Heavy Atom Count:24
Complexity:371

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC(C1=CC(=CC=C1)OCC2=CC=CC=C2C(=O)OC)O

Technology Process of 2-[3-(1-Hydroxy-pentyl)phenoxymethyl]benzoic acid methyl ester

There total 3 articles about 2-[3-(1-Hydroxy-pentyl)phenoxymethyl]benzoic acid methyl 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: 85.0%

: 2417-73-4
methyl 2-bromomethylbenzoate

: 92532-04-2
1-(3-hydroxyphenyl)-1-pentanol

: 92532-05-3
Methyl-2-[[3-(1-hydroxypentyl)phenoxy]methyl]benzoate

Guidance literature:: With caesium carbonate; sodium iodide; In acetone; for 18h; Heating;
DOI:10.1021/jm00384a017

Reference yield:

: 89-71-4
2-Methyl-benzoic acid methyl ester

: 92532-05-3
Methyl-2-[[3-(1-hydroxypentyl)phenoxy]methyl]benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: 61 percent / Br₂ / CCl₄ / Heating; Irradiation

2: 85 percent / NaI, Cs₂CO₃ / acetone / 18 h / Heating

With bromine; caesium carbonate; sodium iodide; In tetrachloromethane; acetone;
DOI:10.1021/jm00384a017

Reference yield:

: 100-83-4
meta-hydroxybenzaldehyde

: 92532-05-3
Methyl-2-[[3-(1-hydroxypentyl)phenoxy]methyl]benzoate

Guidance literature:: Multi-step reaction with 2 steps

1: 79 percent / diethyl ether / 0 - 20 °C

2: 85 percent / NaI, Cs₂CO₃ / acetone / 18 h / Heating

With caesium carbonate; sodium iodide; In diethyl ether; acetone;
DOI:10.1021/jm00384a017