3-[(2-Methylprop-2-en-1-yl)oxy]benzoic acid

Base Information

• Chemical Name: 3-[(2-Methylprop-2-en-1-yl)oxy]benzoic acid
• CAS No.: 149609-84-7
• Molecular Formula: C11H12O3
• Molecular Weight: 192.214
• DSSTox Substance ID: DTXSID00586415
• Wikidata: Q82478540
• Mol file: 149609-84-7.mol

Synonyms:149609-84-7;3-[(2-methylprop-2-en-1-yl)oxy]benzoic acid;3-((2-Methylallyl)oxy)benzoic acid;3-(2-methylprop-2-enoxy)benzoic acid;3-[(2-methyl-2-propen-1-yl)oxy]benzoic acid;3-(2-Methyl-allyloxy)-benzoic acid;3-[(2-methyl-2-propenyl)oxy]benzoic acid;3-((2-METHYLPROP-2-ENYL)OXY)BENZOIC ACID;Benzoic acid, 3-[(2-methyl-2-propen-1-yl)oxy]-;SCHEMBL3315840;DTXSID00586415;3-(2-methylallyloxy)benzoic acid;DGQJTZUEILCDKI-UHFFFAOYSA-N;3-((2-Methylallyl)oxy)benzoicacid;BBL023061;MFCD06801095;STL067036;AKOS000185877;MCULE-3041084301;VS-07316;CS-0316463;AN-329/43385416

Chemical Property of 3-[(2-Methylprop-2-en-1-yl)oxy]benzoic acid

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 340.755oC at 760 mmHg
• PKA: 4.03±0.10(Predicted)
• Flash Point: 133.398oC
• PSA: 46.53000
• Density: 1.128g/cm3
• LogP: 2.33970
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 192.078644241
• Heavy Atom Count: 14
• Complexity: 223

Purity/Quality:

99% ^*data from raw suppliers

3-[(2-Methylprop-2-en-1-yl)oxy]benzoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=C)COC1=CC=CC(=C1)C(=O)O

Technology Process of 3-[(2-Methylprop-2-en-1-yl)oxy]benzoic acid

There total 6 articles about 3-[(2-Methylprop-2-en-1-yl)oxy]benzoic 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: 90.0%

ethyl 3-((2-methylallyl)oxy)benzoate (209256-57-5) → 3-((2-methylallyl)oxy)benzoic acid (149609-84-7)

Guidance literature:

With sodium hydroxide; In ethanol; water; at 70 ℃; for 0.666667h;

DOI:10.1002/anie.201307631

Reference yield:

3-<(2-methylprop-1-en-3-yl)oxy> benzoic acid methyl ester (136954-98-8) → 3-((2-methylallyl)oxy)benzoic acid (149609-84-7)

Guidance literature:

With potassium hydroxide; In methanol; Inert atmosphere;

DOI:10.1039/c4cc00029c

Reference yield:

methyl 3-hydroxybenzoate (19438-10-9) → 3-((2-methylallyl)oxy)benzoic acid (149609-84-7)

Guidance literature:

Multi-step reaction with 2 steps

1: potassium carbonate / N,N-dimethyl-formamide / 12 h / 70 °C / Schlenk technique

2: sodium hydroxide / methanol; water / 5 h / 70 °C / Schlenk technique

With potassium carbonate; sodium hydroxide; In methanol; water; N,N-dimethyl-formamide;

DOI:10.1021/acs.joc.8b01077

upstream raw materials:

ethyl-3-hydroxybenzoate

ethyl 3-((2-methylallyl)oxy)benzoate

3-<(2-methylprop-1-en-3-yl)oxy> benzoic acid methyl ester

methyl 3-hydroxybenzoate

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 149609-84-7 3-((2-METHYLPROP-2-ENYL)OXY)BENZOIC ACID

Send

Send

Metric Ton KG G Pound L ML

Send

Send