4-Chloro-2-methyl-5-nitroaniline

Base Information

• Chemical Name: 4-Chloro-2-methyl-5-nitroaniline
• CAS No.: 34648-99-2
• Molecular Formula: C7H7 Cl N2 O2
• Molecular Weight: 186.598
• Hs Code.: 2921430090
• European Community (EC) Number: 890-036-0
• NSC Number: 159236
• DSSTox Substance ID: DTXSID60303589
• Nikkaji Number: J2.530.740B
• Wikidata: Q82048948
• Mol file: 34648-99-2.mol

Synonyms:4-chloro-2-methyl-5-nitroaniline;34648-99-2;4-CHLORO-5-NITRO-2-TOLUIDINE;NSC159236;SCHEMBL2312589;2-amino-4-nitro-5-chlorotoluene;2-amino-5-chloro-4-nitrotoluene;DTXSID60303589;WUSAYXHDBDAHGU-UHFFFAOYSA-N;AKOS003632269;AM82809;NSC-159236;FT-0704254;EN300-78806;E89216;Z1198147269

Chemical Property of 4-Chloro-2-methyl-5-nitroaniline

Chemical Property:

• Vapor Pressure: 1.2E-05mmHg at 25°C
• Boiling Point: 369.2°Cat760mmHg
• Flash Point: 177.1°C
• PSA: 71.84000
• Density: 1.415g/cm³
• LogP: 3.24320
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 186.0196052
• Heavy Atom Count: 12
• Complexity: 183

Purity/Quality:

98% ^*data from raw suppliers

4-Chloro-2-methyl-5-nitroaniline 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1N)[N+](=O)[O-])Cl

Technology Process of 4-Chloro-2-methyl-5-nitroaniline

There total 10 articles about 4-Chloro-2-methyl-5-nitroaniline 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: 96.0%

→ 4-chloro-2-methyl-5-nitroaniline (34648-99-2)

Guidance literature:

Reference yield: 92.0%

4-chloro-2-methylbenzeneamine (95-69-2) → 4-chloro-2-methyl-5-nitroaniline (34648-99-2)

Guidance literature:

4-chloro-2-methylbenzeneamine; With tert-butyl methyl ether; nitric acid; In tetrahydrofuran; at 0 ℃;

With sulfuric acid; In dichloromethane; at 0 ℃; for 1h; Further stages.;

DOI:10.1016/j.tetlet.2007.10.027

Reference yield:

→ 4-chloro-2-methyl-5-nitroaniline (34648-99-2)

Guidance literature:

With sulfuric acid; man laesst 1 Stde_.stehen und giesst auf Eis;

upstream raw materials:

1-chloro-5-methyl-2,4-dinitrobenzene

4-chloro-2-methylbenzeneamine

sulfuric acid

nitric acid

Downstream raw materials:

4-methylbenzene-1,3-diamine

2,4-diamino-5-chlorotoluene

2-chloro-4-methyl-benzenamine

N-(2-chloro-4-methylphenyl)acetamide