Ethyl 3-bromo-2-hydroxypropanoate

Base Information

• Chemical Name: Ethyl 3-bromo-2-hydroxypropanoate
• CAS No.: 92234-23-6
• Molecular Formula: C5H9BrO3
• Molecular Weight: 197.029
• European Community (EC) Number: 822-476-6
• Mol file: 92234-23-6.mol

Synonyms:ethyl 3-bromo-2-hydroxypropanoate;92234-23-6;SCHEMBL4049912;ethyl3-bromo-2-hydroxypropanoate;PGYLVERCTHVHET-UHFFFAOYSA-N;AKOS026745104;EN300-189696

Chemical Property of Ethyl 3-bromo-2-hydroxypropanoate

Chemical Property:

• Boiling Point: 97 °C (19 mmHg)
• PSA: 46.53000
• LogP: 0.30530
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 195.97351
• Heavy Atom Count: 9
• Complexity: 94.2

Purity/Quality:

ethyl3-bromo-2-hydroxypropanoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(CBr)O

Technology Process of Ethyl 3-bromo-2-hydroxypropanoate

There total 3 articles about Ethyl 3-bromo-2-hydroxypropanoate 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: 88.0%

ethyl Bromopyruvate (70-23-5) → ethyl 3-bromo-2-hydroxy propionate (92234-23-6)

Guidance literature:

With sodium tetrahydroborate; In water; for 48h;

DOI:10.1016/S0022-1139(00)80478-9

Reference yield:

ethyl acrylate (140-88-5,9003-32-1) → ethyl 3-bromo-2-hydroxy propionate (92234-23-6) + ethyl 2-bromo-3-hydroxypropanoate (20591-86-0) + 2,3-dibromopropionic acid ethyl ester (3674-13-3)

Guidance literature:

With bromine; In water; at 30 ℃; Rate constant; Thermodynamic data; Product distribution; other temperatures (22, 38, 46, 54 deg C), ΔH^*, ΔS^*, ΔG^*;

DOI:10.1246/bcsj.57.1394

Reference yield:

2-acetoxy-3-bromo-propionitrile → ethyl 3-bromo-2-hydroxy propionate (92234-23-6)

Guidance literature:

With water; hydrogen bromide; und Erwaermen des Reaktionsprodukts mit Aethanol,Benzol und wenig Sulfosalicylsaeure unter Entfernen des entstehenden Wassers;

upstream raw materials:

ethyl Bromopyruvate

ethyl acrylate

Downstream raw materials:

2-acetoxy-3-(3-ethoxy-2-hydroxy-5-isopropoxycarbonylamino-phenylsulfanyl)-propionic acid ethyl ester

1-Benzyl-5-ethoxy-1,2,3,6-tetrahydro-pyrazine-2-carboxylic acid ethyl ester

3-Azido-2-(benzyl-ethoxycarbonylmethyl-amino)-propionic acid ethyl ester

ethyl imidazo[1,2-a]pyrazine-2-carboxylate