1-(Chloromethyl)-3-methoxy-2-nitrobenzene

Base Information

• Chemical Name: 1-(Chloromethyl)-3-methoxy-2-nitrobenzene
• CAS No.: 53055-06-4
• Molecular Formula: C₈H₈ClNO₃
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID901272481
• Mol file: 53055-06-4.mol

Synonyms:1-(chloromethyl)-3-methoxy-2-nitrobenzene;53055-06-4;SCHEMBL8432682;DTXSID901272481;AKOS014097315;EN300-1983411

Chemical Property of 1-(Chloromethyl)-3-methoxy-2-nitrobenzene

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 201.0192708
• Heavy Atom Count: 13
• Complexity: 183

Purity/Quality:

98.5% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1[N+](=O)[O-])CCl

Technology Process of 1-(Chloromethyl)-3-methoxy-2-nitrobenzene

There total 3 articles about 1-(Chloromethyl)-3-methoxy-2-nitrobenzene 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:

(3-methoxy-2-nitrophenyl)methanol (53055-04-2) → 3-chloromethyl-2-nitro-anisole (53055-06-4)

Guidance literature:

With thionyl chloride;

Reference yield:

3-methoxy 2-nitrobenzaldehyde (53055-05-3) → 3-chloromethyl-2-nitro-anisole (53055-06-4)

Guidance literature:

Multi-step reaction with 2 steps

1: aluminium isopropylate; isopropyl alcohol

2: SOCl₂

With thionyl chloride; aluminum isopropoxide; isopropyl alcohol;

Reference yield:

→ 3-chloromethyl-2-nitro-anisole (53055-06-4)

Guidance literature:

Benzylalkohol, Thionylchlorid;

DOI:10.1021/jm00256a014

upstream raw materials:

(3-methoxy-2-nitrophenyl)methanol

3-methoxy 2-nitrobenzaldehyde

Downstream raw materials:

ethyl-(3-methoxy-2-nitro-benzyl)-amine

ethyl-(2-amino-3-methoxy-benzyl)-amine