1-(Chloromethyl)-2-ethoxybenzene

Base Information

• Chemical Name: 1-(Chloromethyl)-2-ethoxybenzene
• CAS No.: 60906-78-7
• Molecular Formula: C9H11ClO
• Molecular Weight: 170.639
• Hs Code.: 2909309090
• European Community (EC) Number: 816-983-1
• DSSTox Substance ID: DTXSID60368890
• Wikidata: Q72453952
• Mol file: 60906-78-7.mol

Synonyms:1-(chloromethyl)-2-ethoxybenzene;60906-78-7;1-(chloromethyl)-2-ethoxy-benzene;2-ethoxybenzyl chloride;SCHEMBL3149687;DTXSID60368890;SVMOJICBHLWIDJ-UHFFFAOYSA-N;AKOS000117561;A8471;CS-0221711;FT-0751016;EN300-09853;Z56347085

Chemical Property of 1-(Chloromethyl)-2-ethoxybenzene

Chemical Property:

• Vapor Pressure: 0.0823mmHg at 25°C
• Refractive Index: 1.512
• Boiling Point: 234.1 °C at 760 mmHg
• Flash Point: 100.2 °C
• PSA: 9.23000
• Density: 1.082 g/cm³
• LogP: 2.82410
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 170.0498427
• Heavy Atom Count: 11
• Complexity: 106

Purity/Quality:

99% ^*data from raw suppliers

1-(chloromethyl)-2-ethoxybenzene 95 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=CC=CC=C1CCl

Technology Process of 1-(Chloromethyl)-2-ethoxybenzene

There total 6 articles about 1-(Chloromethyl)-2-ethoxybenzene 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:

2-ethoxybenzyl alcohol (71672-75-8) → 1-chloromethyl-2-ethoxybenzene (60906-78-7)

Guidance literature:

With hydrogenchloride; benzene;

Reference yield:

salicylic alcohol (90-01-7) → 1-chloromethyl-2-ethoxybenzene (60906-78-7)

Guidance literature:

Multi-step reaction with 2 steps

1: alcoholic KOH-solution / 20 °C

2: benzene; hydrogen chloride

With hydrogenchloride; potassium hydroxide; benzene;

Reference yield:

2-ethoxybenzonitrile (6609-57-0) → 1-chloromethyl-2-ethoxybenzene (60906-78-7)

Guidance literature:

Multi-step reaction with 3 steps

1: potassium hydroxide; ethylene glycol / Heating

2: lithium aluminium tetrahydride

3: thionyl chloride

With lithium aluminium tetrahydride; thionyl chloride; ethylene glycol; potassium hydroxide;

DOI:10.1002/bkcs.10900

upstream raw materials:

2-ethoxybenzyl alcohol

salicylic alcohol

2-ethoxybenzonitrile

2-ethoxybenzoic acid

Downstream raw materials:

2-ethoxy benzylcyanide

2-ethoxybenzyl magnesium chloride

2-(2-ethoxyphenyl)acetic acid

2-(2-ethoxybenzyloxy)-4-tritylmorpholine

Refernces

• 1、 -. "PIPERAZINE DERIVATIVES WHICH EXHIBIT ACTIVITY AS SEROTONIN AND NORADRENALINE RE-UPATKE INHIBITORS". Page/Page column 47. . Retrieved 2010/02/13.