2-(2-chloroethoxy)acetic Acid

Base Information

• Chemical Name: 2-(2-chloroethoxy)acetic Acid
• CAS No.: 14869-41-1
• Molecular Formula: C4H7ClO3
• Molecular Weight: 138.551
• Hs Code.: 2918990090
• DSSTox Substance ID: DTXSID00448286
• Wikidata: Q82267263
• Mol file: 14869-41-1.mol

Synonyms:2-(2-chloroethoxy)acetic Acid;14869-41-1;2-chloroethoxy acetic acid;2-CHLOROETHOXYACETIC ACID;2 chloroethoxy acetic acid;MFCD17014832;Acetic acid, 2-(2-chloroethoxy)-;2-chlorethoxyacetic acid;Chloro-PEG1-CH2COOH;(2-chloroethoxy)acetic acid;2-(2-chloroethoxy)aceticAcid;SCHEMBL1438928;2-(2-chloroethoxy) acetic acid;Acetic acid, (2-chloroethoxy)-;DTXSID00448286;MHXJETVNZPUVEN-UHFFFAOYSA-N;2-(2-chloro-ethoxy)-acetic acid;AMY28725;AKOS006375837;CS-W006556;AS-31342;SY030518;FT-0687681;EN300-104458;A854531

Chemical Property of 2-(2-chloroethoxy)acetic Acid

Chemical Property:

• Appearance/Colour: Brown crystal
• Vapor Pressure: 0.001mmHg at 25°C
• Melting Point: 32.5-33.0 °C
• Refractive Index: 1.45
• Boiling Point: 289.753 °C at 760 mmHg
• PKA: 3.34±0.10(Predicted)
• Flash Point: 129.038 °C
• PSA: 46.53000
• Density: 1.296 g/cm³
• LogP: 0.32640
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 138.0083718
• Heavy Atom Count: 8
• Complexity: 73.7

Purity/Quality:

99.0%, High purity. ^*data from raw suppliers

2-Chloroethoxyacetic Acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCl)OCC(=O)O
• Uses: A metabolite of Bis(2-chloroethyl) Ether.

Technology Process of 2-(2-chloroethoxy)acetic Acid

There total 9 articles about 2-(2-chloroethoxy)acetic 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: 96.1%

1,4-dioxane (123-91-1,28347-88-8,28347-91-3,39449-24-6,54841-74-6) → (2-chloroethoxy)-acetic acid (14869-41-1)

Guidance literature:

With dipotassium peroxodisulfate; thionyl chloride; at 25 ℃; for 4h;

Reference yield: 95.0%

tert-butyl 2-(2-chloroethoxy)acetate → (2-chloroethoxy)-acetic acid (14869-41-1)

Guidance literature:

With hydrogenchloride; water; for 2h;

Reference yield: 90.0%

(2-chloro-ethoxy)-acetic acid ethyl ester (17229-14-0) → (2-chloroethoxy)-acetic acid (14869-41-1)

Guidance literature:

With sodium hydroxide; In tetrahydrofuran;

DOI:10.1016/j.bmcl.2021.127858

upstream raw materials:

2-chloroethyl cyanomethyl ether

carbon dioxide

(2-chloroethoxy)magnesium chloride

1-chloro-2-(2-nitro-ethoxy)-ethane

Downstream raw materials:

levocetirizine

4-(2-(2-chloroethoxy)acetamido)1-nitrobenzene

(2R)-N-(4-cyanophenyl)-2-hydroxy-2-[(2R)-3-oxo-4-[4-(3-oxomorpholin-4-yl)phenyl]morpholin-2-yl]acetamide

(2-Chloro-ethoxy)-acetic acid methyl ester

Refernces

• 1、 Mederski, Werner W.K.R.,Wendel, Peter Ludwig,Woissyk, Markus. "Practical and efficient processes for the preparation of 4-(4-aminophenyl)morpholin-3-ones on a larger scale: Precursor of factor Xa inhibitors". . p. 437 - 445. Retrieved 2007.
• 2、 -. "PROCESS FOR THE PREPARATION OF 4-(4-AMINOPHENYL)MORPHOLIN-3-ONE". Page/Page column 9-10. . Retrieved 2019/08/20.