Propanoic acid, 3-(4-((4-chlorophenyl)methyl)phenoxy)-, methyl ester

Base Information

• Chemical Name: Propanoic acid, 3-(4-((4-chlorophenyl)methyl)phenoxy)-, methyl ester
• CAS No.: 71549-07-0
• Molecular Formula: C₁₇H₁₇ClO₃
• Molecular Weight: 304.773
• DSSTox Substance ID: DTXSID40221792
• Wikidata: Q83099767
• Mol file: 71549-07-0.mol

Synonyms:BRN 2993251;Sgd 204-76;71549-07-0;Propanoic acid, 3-(4-((4-chlorophenyl)methyl)phenoxy)-, methyl ester;Methyl 3-(4-((4-chlorophenyl)methyl)phenoxy)propanoate;DTXSID40221792;LS-121310

Chemical Property of Propanoic acid, 3-(4-((4-chlorophenyl)methyl)phenoxy)-, methyl ester

Chemical Property:

• Vapor Pressure: 1.71E-07mmHg at 25°C
• Boiling Point: 426.9°C at 760 mmHg
• Flash Point: 161.9°C
• PSA: 35.53000
• Density: 1.182g/cm³
• LogP: 3.87270
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 304.0866221
• Heavy Atom Count: 21
• Complexity: 305

Purity/Quality:

99% ^*data from raw suppliers

METHYL 3-[4-[(4-CHLOROPHENYL)METHYL]PHENOXY]PROPANOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCOC1=CC=C(C=C1)CC2=CC=C(C=C2)Cl

Technology Process of Propanoic acid, 3-(4-((4-chlorophenyl)methyl)phenoxy)-, methyl ester

There total 1 articles about Propanoic acid, 3-(4-((4-chlorophenyl)methyl)phenoxy)-, methyl ester 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:

Methyl 3-bromopropionate (3395-91-3) + 4-(4-chloro-benzyl)-phenol (52890-73-0) → 3-[4-(4-Chloro-benzyl)-phenoxy]-propionic acid methyl ester (71549-07-0)

Guidance literature:

Multistep reaction; (i) K₂CO₃, xylene, (ii) /BRN= 1742949/;

upstream raw materials:

Methyl 3-bromopropionate

4-(4-chloro-benzyl)-phenol