2-(3,5-Di-tert-butylphenyl)acetic acid

Base Information

Chemical Name:2-(3,5-Di-tert-butylphenyl)acetic acid
CAS No.:42288-54-0
Molecular Formula:C16H24O2
Molecular Weight:248.365
Hs Code.:2916399090
DSSTox Substance ID:DTXSID30429104
Nikkaji Number:J3.357.154B
Wikidata:Q82242015
Mol file:42288-54-0.mol

Synonyms:42288-54-0;2-(3,5-Di-tert-butylphenyl)acetic acid;2-(3,5-ditert-butylphenyl)acetic acid;(3,5-ditert-butylphenyl)acetic acid;(3,5-Di-tert-butylphenyl)acetic acid;AE-562/43287080;SCHEMBL10717865;DTXSID30429104;VOMXJSLQKJJZSU-UHFFFAOYSA-N;3,5-ditert-butylphenyl)acetic acid;(3,5-Di-t-butylphenyl)acetic acid;MFCD09260820;AM90098;2-(3,5-Di-tert-butylphenyl)aceticacid;FT-0696238;A872915

Suppliers and Price of 2-(3,5-Di-tert-butylphenyl)acetic acid

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

Rieke Metals
(3,5-Di-tert-butylphenyl)aceticacid
5g
$ 1728.00

Rieke Metals
(3,5-Di-tert-butylphenyl)aceticacid
1g
$ 661.00

Labseeker
2-(3,5-ditert-butylphenyl)aceticacid 95
10g
$ 2292.00

Crysdot
2-(3,5-Di-tert-butylphenyl)aceticacid 95+%
1g
$ 313.00

American Custom Chemicals Corporation
2-(3,5-DITERT-BUTYLPHENYL)ACETIC ACID 95.00%
5MG
$ 504.21

Alichem
2-(3,5-Di-tert-butylphenyl)aceticacid
1g
$ 400.00

Total 14 raw suppliers

Chemical Property of 2-(3,5-Di-tert-butylphenyl)acetic acid

Chemical Property:

Boiling Point:319.0±11.0 °C(Predicted)
PKA:4.31±0.10(Predicted)
PSA：37.30000
Density:0.992±0.06 g/cm3(Predicted)
LogP:3.90870
Storage Temp.:2-8°C
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:248.177630004
Heavy Atom Count:18
Complexity:271

Purity/Quality:

97% ^*data from raw suppliers

(3,5-Di-tert-butylphenyl)aceticacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 2-(3,5-Di-tert-butylphenyl)acetic acid

There total 5 articles about 2-(3,5-Di-tert-butylphenyl)acetic acid 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: 88.0%

: 77387-58-7
2-[3,5-di-(tert-butyl)phenyl]acetonitrile

: 42288-54-0
2-(3,5-Di-tert-butylphenyl)essigsaeure

Guidance literature:: With potassium hydroxide; In tetrahydrofuran; ethanol; at 100 ℃; for 192h;
DOI:10.1021/ol050987f

Reference yield:

: 62938-08-3
3,5-di-tert-butylbenzyl bromide

: 42288-54-0
2-(3,5-Di-tert-butylphenyl)essigsaeure

Guidance literature:: Multi-step reaction with 2 steps

1: 60 percent / dimethylsulfoxide / 20 h / 20 °C

2: 88 percent / aq. KOH / tetrahydrofuran; ethanol / 192 h / 100 °C

With potassium hydroxide; In tetrahydrofuran; ethanol; dimethyl sulfoxide;
DOI:10.1021/ol050987f

Reference yield:

: 36720-94-2
1,3-di-tert-butyl-5-ethynylbenzene

: 42288-54-0
2-(3,5-Di-tert-butylphenyl)essigsaeure

Guidance literature:: 1,3-di-tert-butyl-5-ethynylbenzene; With n-butyllithium; In tetrahydrofuran; at -78 ℃; for 1h;

With 2-Isopropoxy-4,4,5,5-tetramethyl-1,3,2-dioxaborolane; In tetrahydrofuran; for 2h;

With oxone; In acetone; at 50 ℃; for 12h;