2,2,3-Tribromopropanal

Base Information

• Chemical Name: 2,2,3-Tribromopropanal
• CAS No.: 26944-17-2
• Molecular Formula: C3H3Br3O
• Molecular Weight: 294.768
• Hs Code.: 2913000090
• European Community (EC) Number: 838-630-0
• DSSTox Substance ID: DTXSID0073455
• Nikkaji Number: J1.611.449I
• Wikidata: Q72509924
• Mol file: 26944-17-2.mol

Synonyms:2,2,3-tribromopropanal;26944-17-2;Propanal, 2,2,3-tribromo-;C3H3Br3O;2,2,3 tribromopropanal;2,2,3-Tribromopropionaldehyde;C3-H3-Br3-O;SCHEMBL1574707;2,2,3-tribromo-propionaldehyde;DTXSID0073455;MFCD16620398;AKOS015836018;CS-W018618;DS-5103;FT-0686787;D78270;EN300-198861;A848210

Chemical Property of 2,2,3-Tribromopropanal

Chemical Property:

• Vapor Pressure: 0.163mmHg at 25°C
• Refractive Index: 1.599
• Boiling Point: 213.6 °C at 760 mmHg
• Flash Point: 84.7 °C
• PSA: 17.07000
• Density: 2.563 g/cm³
• LogP: 2.06630
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• XLogP3: 2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 293.77135
• Heavy Atom Count: 7
• Complexity: 70.6

Purity/Quality:

97% ^*data from raw suppliers

2,2,3-Tribromopropanal ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(C=O)(Br)Br)Br
• Uses: 2,2,3-Tribromopropanal is a versatile reagent that was used for the first time in the 1950s. It is used as a reagent in the Skraup-type synthesis of 3-bromoquinolin-6-ols. 2,2,3-Tribromopropanal is also used in the preparation of quinolinyloxyacetamides, a novel class of tubulin polymerization inhibitors with fungicidal activity.

Technology Process of 2,2,3-Tribromopropanal

There total 1 articles about 2,2,3-Tribromopropanal 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:

4,4,5-tribromo-pent-2-enoic acid → 2,2,3-tribromopropanal (26944-17-2) + oxalic acid (144-62-7,97993-78-7)

Guidance literature:

bei Ozonabbau;

Reference yield: 71.0%

2,2,3-tribromopropanal (26944-17-2) + (R)-7-Amino-3-(1-methyl-1H-tetrazol-5-ylsulfanylmethyl)-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester (53090-86-1) → (R)-3-(1-Methyl-1H-tetrazol-5-ylsulfanylmethyl)-8-oxo-7-[2,2,3-tribromo-prop-(E)-ylideneamino]-5-thia-1-aza-bicyclo[4.2.0]oct-2-ene-2-carboxylic acid benzhydryl ester (83934-70-7)

Guidance literature:

With thionyl chloride; N,N-dimethyl-aniline; In dichloromethane; at -20 ℃; for 1h;

DOI:10.1016/S0040-4039(00)87510-3

Reference yield: 38.2%

2,2,3-tribromopropanal (26944-17-2) + 4-nitro-aniline (100-01-6,104810-17-5) → 3-bromo-6-nitroquinoline (7101-95-3)

Guidance literature:

With acetic acid; at 110 ℃; for 2h;

DOI:10.1016/j.ejmech.2021.113579

Downstream raw materials:

folic acid

3,8-dibromo-6-nitro-quinoline

6-bromo-8-nitroquinoline

3-Bromo-6-chloro-8-nitroquinoline