2,6-Dichloro-3-nitrobenzaldehyde

Base Information

• Chemical Name: 2,6-Dichloro-3-nitrobenzaldehyde
• CAS No.: 5866-97-7
• Molecular Formula: C7H3 Cl2 N O3
• Molecular Weight: 220.012
• Hs Code.: 2913000090
• European Community (EC) Number: 622-548-5
• DSSTox Substance ID: DTXSID90383490
• Nikkaji Number: J81.108D
• Wikidata: Q72467065
• Mol file: 5866-97-7.mol

Synonyms:2,6-dichloro-3-nitrobenzaldehyde;5866-97-7;2,6-Dichloro-3-nitro-benzaldehyde;MFCD00090332;BENZALDEHYDE, 2,6-DICHLORO-3-NITRO-;SCHEMBL1115822;DTXSID90383490;CQOQHGBSJIWOCA-UHFFFAOYSA-N;BBL023515;CK2099;STL284485;AKOS015850148;AB03261;DS-0088;PS-4516;AC-31894;SY064498;AM20050098;CS-0168986;FT-0635886;EN300-214744;A831972;J-507421;Z1269141335

Chemical Property of 2,6-Dichloro-3-nitrobenzaldehyde

Chemical Property:

• Appearance/Colour: white solid.
• Vapor Pressure: 0.000406mmHg at 25°C
• Melting Point: 165 °C
• Refractive Index: 1.64
• Boiling Point: 316.6 °C at 760 mmHg
• Flash Point: 145.3 °C
• PSA: 62.89000
• Density: 1.607 g/cm³
• LogP: 3.23730
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 218.9489983
• Heavy Atom Count: 13
• Complexity: 218

Purity/Quality:

98%min ^*data from raw suppliers

2,6-Dichloro-3-nitrobenzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1[N+](=O)[O-])Cl)C=O)Cl

Technology Process of 2,6-Dichloro-3-nitrobenzaldehyde

There total 3 articles about 2,6-Dichloro-3-nitrobenzaldehyde 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: 96.2%

2,6-dichlorobenzaldehyde (83-38-5) → 2,6-dichloro-3-nitrobenzaldehyde (5866-97-7)

Guidance literature:

With sulfuric acid; nitric acid; at 10 ℃; for 1.5h;

DOI:10.1021/jm970591c

Reference yield:

2,6-dichlorotoluene (118-69-4) → 2,6-dichloro-3-nitrobenzaldehyde (5866-97-7)

Guidance literature:

Multi-step reaction with 2 steps

1: manganese(IV) oxide; sulfuric acid

2: durch Nitrieren

With manganese(IV) oxide; sulfuric acid;

Reference yield:

→ 2,6-dichloro-3-nitrobenzaldehyde (5866-97-7)

Guidance literature:

upstream raw materials:

2,6-dichlorobenzaldehyde

2,6-dichlorotoluene

Downstream raw materials:

2-<(2,6-dichloro-3-nitrobenzyl)amino>propionamide

2,6-Dichloro-3-nitrobenzyl alcohol

3-nitro-2,6-bis-(toluene-4-sulfonylamino)-benzaldehyde

Refernces

• 1、 -. "N-SUBSTUTUTED-6-OXO-1,6-DIHYDROPYRIMIDINE-2-YL DERIVATIVES AS INHIBITORS OF THE HUMAN IMMUNODEFICIENCY VIRUS REPLICATION". Page/Page column 22. . Retrieved 2021/04/10.
• 2、 -. "INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION". Page/Page column 19-20. . Retrieved 2021/09/11.