Benzoic acid, 3-(2-propynyloxy)-

Base Information

Chemical Name:Benzoic acid, 3-(2-propynyloxy)-
CAS No.:85607-73-4
Molecular Formula:C10H8O3
Molecular Weight:176.172
Hs Code.:
European Community (EC) Number:963-279-6
DSSTox Substance ID:DTXSID90519499
Nikkaji Number:J1.831.617J
Wikidata:Q82382724

Synonyms:85607-73-4;Benzoic acid, 3-(2-propynyloxy)-;3-prop-2-ynoxybenzoic acid;3-(2-propyn-1-yloxy)Benzoic acid;3-(prop-2-yn-1-yloxy)benzoic acid;m-propargyloxybenzoic acid;SCHEMBL4398914;3-(prop-2-ynyloxy)benzoic acid;DTXSID90519499;HERILFFCDZRBMN-UHFFFAOYSA-N;MFCD09259068;AKOS000195779;3-[(Prop-2-yn-1-yl)oxy]benzoic acid;BS-42529;CS-0365546;F93670;F2158-1675

Suppliers and Price of Benzoic acid, 3-(2-propynyloxy)-

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

Total 4 raw suppliers

Chemical Property of Benzoic acid, 3-(2-propynyloxy)-

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:176.047344113
Heavy Atom Count:13
Complexity:226

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C#CCOC1=CC=CC(=C1)C(=O)O

Technology Process of Benzoic acid, 3-(2-propynyloxy)-

There total 7 articles about Benzoic acid, 3-(2-propynyloxy)- 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: 99.0%

: 160893-68-5
m-methoxycarbonylphenyl propargyl ether

: 85607-73-4
3-(prop-2-yn-1-yloxy)benzoic acid

Guidance literature:: With water; potassium hydroxide; In ethanol; at 20 ℃; for 4h;
DOI:10.1002/anie.201607338

Reference yield: 86.4%

: 19438-10-9
methyl 3-hydroxybenzoate

: 106-96-7
propargyl bromide

: 85607-73-4
3-(prop-2-yn-1-yloxy)benzoic acid

Guidance literature:: methyl 3-hydroxybenzoate; propargyl bromide; With potassium carbonate; In N,N-dimethyl-formamide; at 105 ℃; for 5h;

With water; sodium hydroxide; In methanol; at 105 ℃; for 2h;

Reference yield:

: 91920-00-2
ethyl 3-(prop-2-yn-1-yloxy)benzoate

: 85607-73-4
3-(prop-2-yn-1-yloxy)benzoic acid

Guidance literature:: ethyl 3-(prop-2-yn-1-yloxy)benzoate; With lithium hydroxide; water; In 1,4-dioxane; at 20 ℃; for 16h;

With sodium hydrogen sulfate; In water; pH=2;