3-(3-Bromophenyl)-2-oxopropanoic acid

Base Information

• Chemical Name: 3-(3-Bromophenyl)-2-oxopropanoic acid
• CAS No.: 207910-90-5
• Molecular Formula: C9H7BrO3
• Molecular Weight: 243.057
• European Community (EC) Number: 867-496-6
• Nikkaji Number: J964.042H
• Mol file: 207910-90-5.mol

Synonyms:3-(3-bromophenyl)-2-oxopropanoic acid;207910-90-5;Benzenepropanoic acid, 3-broMo-.alpha.-oxo-;SCHEMBL6669579;MFCD09739170;3-(3-bromophenyl)-2-oxopropanoicacid;AKOS000146091;MCULE-6912901512;SY338814;CS-0216389;EN300-41881;C91155;A1-02027

Chemical Property of 3-(3-Bromophenyl)-2-oxopropanoic acid

Chemical Property:

• PSA: 54.37000
• LogP: 1.64530
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 241.95786
• Heavy Atom Count: 13
• Complexity: 215

Purity/Quality:

98%min ^*data from raw suppliers

3-(3-BROMOPHENYL)-2-OXOPROPANOIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)Br)CC(=O)C(=O)O
• Uses: 3-(3-Bromophenyl)-2-oxopropanoic Acid is used in the preparation of carbonic anhydrase XII inhibitors in chemotherapeutic drugs.

Technology Process of 3-(3-Bromophenyl)-2-oxopropanoic acid

There total 4 articles about 3-(3-Bromophenyl)-2-oxopropanoic 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:

(4Z)-((3-bromophenyl)methylene)-2-methyloxazole-5(4H)one (906722-01-8) → 3-(3-bromophenyl)-2-oxopropanoic acid (207910-90-5)

Guidance literature:

(4Z)-((3-bromophenyl)methylene)-2-methyloxazole-5(4H)one; With sodium hydroxide; at 80 ℃;

With hydrogenchloride; for 5h; Heating;

DOI:10.1016/j.bmcl.2004.08.024

Reference yield:

4-(3-bromobenzylidene)-2-methyl-1,3-oxazol-5(4H)-one (906722-01-8) → 3-(3-bromophenyl)-2-oxopropanoic acid (207910-90-5)

Guidance literature:

4-(3-bromobenzylidene)-2-methyl-1,3-oxazol-5(4H)-one; With sodium hydroxide; at 85 ℃; for 2h;

With hydrogenchloride; In water; Reflux;

Reference yield:

m-bromobenzoic aldehyde (3132-99-8) → 3-(3-bromophenyl)-2-oxopropanoic acid (207910-90-5)

Guidance literature:

Multi-step reaction with 2 steps

1.1: NaOAc; Ac₂O / 5 h / Heating

2.1: aq. NaOH / 80 °C

2.2: aq. HCl / 5 h / Heating

With sodium hydroxide; sodium acetate; acetic anhydride;

DOI:10.1016/j.bmcl.2004.08.024

upstream raw materials:

(4Z)-((3-bromophenyl)methylene)-2-methyloxazole-5(4H)one

m-bromobenzoic aldehyde

(4E)-4-[(3-bromophenyl)methylidene]-2-methyl-4,5-dihydro-1,3-oxazol-5-one

4-(3-bromobenzylidene)-2-methyl-1,3-oxazol-5(4H)-one

Downstream raw materials:

(E)-3-(3-bromophenyl)-2-(tetrahydro-2H-pyran-2-yloxyimino)-propanoic acid

C₁₈H₁₄BrNO₃

C₁₇H₁₁BrClNO₂

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 207910-90-5 Benzenepropanoic acid, 3-broMo-.alpha.-oxo-

Send

Send

Metric Ton KG G Pound L ML

Send

Send