4-(2-Chloroethoxy)benzaldehyde

Base Information

• Chemical Name: 4-(2-Chloroethoxy)benzaldehyde
• CAS No.: 54373-15-8
• Molecular Formula: C9H9ClO2
• Molecular Weight: 184.622
• Hs Code.: 2913000090
• DSSTox Substance ID: DTXSID30969474
• Nikkaji Number: J2.898.217H
• Mol file: 54373-15-8.mol

Synonyms:4-(2-Chloroethoxy)benzaldehyde;54373-15-8;p-(2-Chloroethoxy)benzaldehyde;Benzaldehyde, 4-(2-chloroethoxy)-;4-chloroethoxybenzaldehyde;SCHEMBL4129236;4-(2-chloroethoxy)-benzaldehyde;DTXSID30969474;p-(2-chloro-ethoxy)-benzaldehyde;4-(2-Chloroethoxy)benzaldehyde #;MFCD00043699;AKOS000295502;AB01954;AS-18010;CS-0157427;FT-0640242;EN300-7363273;A830134;Z1201618019

Chemical Property of 4-(2-Chloroethoxy)benzaldehyde

Chemical Property:

• Vapor Pressure: 0.000673mmHg at 25°C
• Melting Point: 25-30 °C
• Refractive Index: 1.555
• Boiling Point: 308.6 °C at 760 mmHg
• Flash Point: 137.6 °C
• PSA: 26.30000
• Density: 1.206 g/cm³
• LogP: 2.11670
• Storage Temp.: Inert atmosphere,Room Temperature
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 184.0291072
• Heavy Atom Count: 12
• Complexity: 131

Purity/Quality:

99% ^*data from raw suppliers

4-(2-Chloroethoxy)benzaldehyde ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C=O)OCCCl

Technology Process of 4-(2-Chloroethoxy)benzaldehyde

There total 7 articles about 4-(2-Chloroethoxy)benzaldehyde 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: 92.0%

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) + 1-Bromo-2-chloroethane (107-04-0) → 4-(2-chloroethoxy)benzaldehyde (54373-15-8)

Guidance literature:

With potassium carbonate; In acetonitrile; for 15h; Reflux;

DOI:10.1002/cmdc.201200316 DOI:10.1080/14756366.2020.1713771

Reference yield: 81.0%

4-hydroxy-benzaldehyde (123-08-0,65581-83-1) + 1,2-dichloro-ethane (107-06-2,52399-93-6) → 4-(2-chloroethoxy)benzaldehyde (54373-15-8)

Guidance literature:

With tetra(n-butyl)ammonium hydrogensulfate; potassium carbonate; sodium sulfite; In ethylene glycol; for 30h; Reflux;

DOI:10.1007/s11172-017-1732-9

Reference yield: 74.0%

2-chloroethyl tosylate (80-41-1) + 4-hydroxy-benzaldehyde (123-08-0,65581-83-1) → 4-(2-chloroethoxy)benzaldehyde (54373-15-8)

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide; at 105 ℃; for 4h;

DOI:10.1021/jm00010a005

upstream raw materials:

4-hydroxy-benzaldehyde

1-Bromo-2-chloroethane

2-chloroethyl tosylate

1-chloro-2-iodoethane

Downstream raw materials:

(Z)-2-(5-Chloro-benzo[d]isoxazol-3-yl)-3-[4-(2-chloro-ethoxy)-phenyl]-acrylonitrile

(Z)-3-[4-(2-Chloro-ethoxy)-phenyl]-2-(5-methoxy-benzo[d]isoxazol-3-yl)-acrylonitrile

4-[2-(2(3H)-benzoxazolon-3-yl)ethoxy]benzaldehyde

4-[2-(2(3H)-benzothiazolon-3-yl)ethoxy]benzaldehyde

Refernces

• 1、 Wang, Caolin,Xu, Shan,Peng, Liang,Zhang, Bingliang,Zhang, Hong,Hu, Yingying,Zheng, Pengwu,Zhu, Wufu. "Design, synthesis and biological evaluation of novel 4-anlinoquinazoline derivatives as EGFR inhibitors with the potential to inhibit the gefitinib-resistant nonsmall cell lung cancers". . p. 204 - 218. Retrieved 2019/01/03.
• 2、 -. "USE OF DISUBSTITUTED BENZENES TO CONTROL INSECTICIDE-RESISTANT PESTS". Page/Page column 39. . Retrieved 2018/11/26.