Methyl 2-chloro-3-hydroxypropionate

Base Information

• Chemical Name: Methyl 2-chloro-3-hydroxypropionate
• CAS No.: 98070-39-4
• Molecular Formula: C4H7ClO3
• Molecular Weight: 138.551
• Hs Code.: 2918199090
• European Community (EC) Number: 623-382-6
• DSSTox Substance ID: DTXSID40377804
• Nikkaji Number: J2.774.005G
• Mol file: 98070-39-4.mol

Synonyms:98070-39-4;Methyl 2-chloro-3-hydroxypropionate;methyl 2-chloro-3-hydroxypropanoate;2-Chloro-3-hydroxypropionic acid methyl ester;2-CHLORO-3-HYDROXYPROPIONICACIDMETHYLESTER;MFCD07368971;2-Chloro-3-hydroxypropanoic acid methyl ester;Propanoic acid, 2-chloro-3-hydroxy-, methyl ester;SCHEMBL1268153;DTXSID40377804;GEO-00689;AKOS005254414;Methyl 2-chloro-3-hydroxypropionate, 95%;FT-0729431

Chemical Property of Methyl 2-chloro-3-hydroxypropionate

Chemical Property:

• Vapor Pressure: 0.0213mmHg at 25°C
• Refractive Index: 1.4536
• Boiling Point: 105-109oC/20mm
• PKA: 13.45±0.10(Predicted)
• Flash Point: 105-109°C/20mm
• PSA: 46.53000
• Density: 1.319
• LogP: -0.24090
• Storage Temp.: 2-8°C
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 138.0083718
• Heavy Atom Count: 8
• Complexity: 83.4

Purity/Quality:

98%Min ^*data from raw suppliers

Methyl 2-chloro-3-hydroxypropionate 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C(CO)Cl

Technology Process of Methyl 2-chloro-3-hydroxypropionate

There total 1 articles about Methyl 2-chloro-3-hydroxypropionate 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:

C18H15Cl5O4 (1205122-01-5) + trifluoroacetic acid (76-05-1) → (2,6-dichloro-4-methoxyphenyl)-(2,4-dichlorophenyl)methyl 2,2,2-trifluoroacetate (954143-62-5) + methyl 2-chloro-3-hydroxypropionate (98070-39-4)

Guidance literature:

In dichloromethane; at 20 ℃;

DOI:10.1055/s-0029-1216974

Reference yield: 98.0%

methyl 2-chloro-3-hydroxypropionate (98070-39-4) + (2,6-dichloro-4-methoxyphenyl)-(2,4-dichlorophenyl)methyl trichloroacetimidate (1205121-89-6) → C18H15Cl5O4 (1205122-01-5)

Guidance literature:

With trimethylsilyl trifluoromethanesulfonate; In dichloromethane; at 20 ℃; for 0.166667h;

DOI:10.1055/s-0029-1216974

Reference yield:

methyl 2-chloro-3-hydroxypropionate (98070-39-4) → methyl 2-chloroacrylate (80-63-7)

Guidance literature:

With sulfuric acid; copper(l) chloride;

upstream raw materials:

C₁₈H₁₅Cl₅O₄

trifluoroacetic acid

Downstream raw materials:

methyl 2-chloroacrylate

C₁₈H₁₅Cl₅O₄

Refernces