2-Bromo-5-propoxybenzoic acid

Base Information

Chemical Name:2-Bromo-5-propoxybenzoic acid
CAS No.:190965-43-6
Molecular Formula:C₁₀H₁₁BrO₃
Molecular Weight:259.1
Hs Code.:
DSSTox Substance ID:DTXSID00700174
Wikidata:Q82631385
Mol file:190965-43-6.mol

Synonyms:2-bromo-5-n-propyloxybenzoic acid;2-BROMO-5-PROPOXYBENZOIC ACID;190965-43-6;DTXSID00700174;AKOS017558590;A1-24835

Suppliers and Price of 2-Bromo-5-propoxybenzoic 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

American Custom Chemicals Corporation
2-BROMO-5-N-PROPYLOXYBENZOIC ACID 95.00%
5MG
$ 499.27

A1 Biochem Labs
2-Bromo-5-propoxybenzoicacid 95%
5 g
$ 1150.00

A1 Biochem Labs
2-Bromo-5-propoxybenzoicacid 95%
1 g
$ 550.00

Total 2 raw suppliers

Chemical Property of 2-Bromo-5-propoxybenzoic acid

Chemical Property:

PSA：46.53000
LogP:2.93610
XLogP3:2.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:257.98916
Heavy Atom Count:14
Complexity:196

Purity/Quality:

97% ^*data from raw suppliers

2-BROMO-5-N-PROPYLOXYBENZOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCOC1=CC(=C(C=C1)Br)C(=O)O

Technology Process of 2-Bromo-5-propoxybenzoic acid

There total 2 articles about 2-Bromo-5-propoxybenzoic 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:

: 195005-37-9
2-bromo-5-propoxybenzaldehyde

: 190965-43-6
2-bromo-5-propoxy-benzoic acid

Guidance literature:: With potassium permanganate; In water; acetone; for 1.5h; Heating;
DOI:10.1016/j.tet.2006.07.075

Reference yield:

: 2973-80-0
2-bromo-5-hydroxybenzaldehyde

: 190965-43-6
2-bromo-5-propoxy-benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: K₂CO₃ / ethanol; H₂O / 17 h / Heating

2: KMnO₄ / acetone; H₂O / 1.5 h / Heating

With potassium permanganate; potassium carbonate; In ethanol; water; acetone;
DOI:10.1016/j.tet.2006.07.075

Reference yield:

: 190965-43-6
2-bromo-5-propoxy-benzoic acid

: 913648-48-3
1-benzo[1,3]-dioxol-5-yl-3-[4-methoxy-2-(2-methoxymethoxyethoxy)phenyl]-5-propoxy-1H-indene-2-carboxylic acid tert-butyl ester

Guidance literature:: Multi-step reaction with 6 steps

1.1: H₂SO₄ / 6 h / Heating

2.1: 5.3 g / P(o-tol)3; Et₃N / PdCl₂(MeCN)2 / dimethylformamide / 10 h / 100 °C

3.1: KOH; (R,R)-chiraphos / [Rh(nbd)2]BF₄ / dioxane; H₂O / 20 h / 60 °C

4.1: NaHMDS / tetrahydrofuran / 3.5 h / -78 - -15 °C

5.1: NaH / diethyl ether / 0.75 h / -5 °C

5.2: diethyl ether / 1 h / -5 °C

6.1: K₂CO₃ / PdCl₂(dppf) / toluene; H₂O / 4 h / 70 °C

With potassium hydroxide; sulfuric acid; (R,R)-chiraphos; sodium hexamethyldisilazane; sodium hydride; potassium carbonate; triethylamine; tris-(o-tolyl)phosphine; dichloro bis(acetonitrile) palladium(II); (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; di(norbornadiene)rhodium(I) tetrafluoroborate; In tetrahydrofuran; 1,4-dioxane; diethyl ether; water; N,N-dimethyl-formamide; toluene; 2.1: Heck coupling / 4.1: Claisen cyclization;
DOI:10.1016/j.tet.2006.07.075