Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-, methyl ester

Base Information

Chemical Name:Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-, methyl ester
CAS No.:36837-50-0
Molecular Formula:C14H20O3
Molecular Weight:236.311
Hs Code.:2918290000
DSSTox Substance ID:DTXSID2074039
Nikkaji Number:J1.321.094B
Wikidata:Q82002575
Mol file:36837-50-0.mol

Synonyms:36837-50-0;Methyl 3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate;Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-, methyl ester;methyl 3-(3-tert-butyl-4-hydroxyphenyl)propanoate;METHYL 3-(3-TERT-BUTYL-4-HYDROXYPHENYL)PROPIONATE;SCHEMBL490455;DTXSID2074039;TVUZOWCUYWPFPN-UHFFFAOYSA-N;MFCD19441367;DS-19571;CS-0161248;D71058;Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate;3-tert-Butyl-4-hydroxybenzenepropanoic acid methyl ester;3-(3-tert-butyl-4-hydroxy-phenyl)-propionic acid methyl ester;3-(4-hydroxy-3-tert.butylphenyl) propionic acid methyl ester

Suppliers and Price of Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-, methyl 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

Crysdot
Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate 97%
100g
$ 166.00

Ambeed
Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate 97%
25g
$ 54.00

Ambeed
Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate 97%
10g
$ 26.00

Ambeed
Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate 97%
5g
$ 17.00

Ambeed
Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate 97%
100g
$ 151.00

Alichem
Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate
100g
$ 159.00

AK Scientific
Benzenepropanoicacid,3-(1,1-dimethylethyl)-4-hydroxy-,methylester
10g
$ 95.00

Total 15 raw suppliers

Chemical Property of Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-, methyl ester

Chemical Property:

Vapor Pressure:0.000154mmHg at 25°C
Melting Point:60-61 °C
Boiling Point:321.9oC at 760 mmHg
PKA:11.30±0.20(Predicted)
Flash Point:125.7oC
PSA：46.53000
Density:1.055g/cm3
LogP:2.79530
Storage Temp.:Inert atmosphere,Room Temperature
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:236.14124450
Heavy Atom Count:17
Complexity:255

Purity/Quality:

97% ^*data from raw suppliers

Methyl3-(3-(tert-butyl)-4-hydroxyphenyl)propanoate 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1=C(C=CC(=C1)CCC(=O)OC)O

Technology Process of Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-, methyl ester

There total 3 articles about Benzenepropanoic acid, 3-(1,1-dimethylethyl)-4-hydroxy-, 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:

: 6386-38-5
methyl 3-(4-hydroxy-3,5-di-tert-butyl)phenylpropanoate

: 128-39-2
2,6-di-tert-butylphenol

: 5597-50-2
3-(4-hydroxyphenyl)propionic acid methyl ester

: C₂₇H₃₆O₅

: 36837-50-0
methyl 3-(3-tert-butyl-4-hydroxyphenyl)propionate

Guidance literature:: With toluene-4-sulfonic acid; at 90 ℃;

Reference yield:

: 6386-38-5
methyl 3-(4-hydroxy-3,5-di-tert-butyl)phenylpropanoate

: 5597-50-2
3-(4-hydroxyphenyl)propionic acid methyl ester

: 36837-50-0
methyl 3-(3-tert-butyl-4-hydroxyphenyl)propionate

: 115-11-7,15220-85-6
isobutene

Guidance literature:: With phosphotungstic acid; In acetic acid; at 100 ℃; Product distribution; catalysis of dealkylation of 2,6-di-tert-butylphenol derivatives by heteropoly acids;
DOI:10.1007/BF00962297