2-Chloro-3-nitrophenol

Base Information

• Chemical Name: 2-Chloro-3-nitrophenol
• CAS No.: 603-84-9
• Molecular Formula: C6H4ClNO3
• Molecular Weight: 173.556
• Hs Code.: 2908999090
• DSSTox Substance ID: DTXSID10209062
• Nikkaji Number: J95.664C
• Wikidata: Q72455886
• Mol file: 603-84-9.mol

Synonyms:2-Chloro-3-nitrophenol;603-84-9;Phenol, 2-chloro-3-nitro-;2-CHLORO-3-NITRO-PHENOL;MFCD11035882;2-Chlor-3-nitro-phenol;SCHEMBL1273865;DTXSID10209062;QBGLHYQUZJDZOO-UHFFFAOYSA-N;CS-B0020;AKOS006308573;MB09030;AC-22652;AS-18440;SY034447;Propanamide, N-[(2-methoxyphenyl)methyl]-;A8427;AM20080639;FT-0649255;AN-584/43422711;J-508679

Chemical Property of 2-Chloro-3-nitrophenol

Chemical Property:

• Appearance/Colour: Orange crystalline powder
• Vapor Pressure: 0.002mmHg at 25°C
• Melting Point: 120.5 °C
• Refractive Index: 1.627
• Boiling Point: 279.6 °C at 760 mmHg
• PKA: 7.39±0.25(Predicted)
• Flash Point: 122.9 °C
• PSA: 66.05000
• Density: 1.554 g/cm³
• LogP: 2.47700
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 172.9879707
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Chloro-3-nitrophenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-Chloro-3-nitrophenol

There total 19 articles about 2-Chloro-3-nitrophenol 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: 69.0%

5-Nitro-2-aminophenol (121-88-0) → 2-chloro-3-nitrophenol (603-84-9)

Guidance literature:

5-Nitro-2-aminophenol; With hydrogenchloride; In 1,4-dioxane; at 70 ℃;

With sodium nitrite; In water; at 0 ℃; for 3h;

With hydrogenchloride; copper(l) chloride; In water; at 0 - 60 ℃; for 0.5h;

Reference yield: 62.0%

2-Amino-3-nitrophenol (603-85-0) → 2-chloro-3-nitrophenol (603-84-9)

Guidance literature:

2-Amino-3-nitrophenol; With hydrogenchloride; sodium nitrite; In water; at 0 ℃; for 0.5h;

With sulfuric acid; copper(l) chloride; In water; for 18h;

Reference yield: 32.0%

meta-nitrophenol (554-84-7) → 2-chloro-3-nitrophenol (603-84-9)

Guidance literature:

With potassium chlorate; In hydrogenchloride; dichloromethane; water; toluene;

upstream raw materials:

meta-nitrophenol

2-chloro-3-methoxynitrobenzene

2-chloro-3-nitro-phenetole

chlorine

Downstream raw materials:

2-chloro-3-methoxynitrobenzene

2-chloro-3-[(1-methylethyl)oxy]aniline

Refernces

• 1、 -. "DIKETOPIPERAZINE DERIVATIVES AS P2X7 MODULATORS". Page/Page column 103. . Retrieved 2010/11/17.
• 2、 -. "HEPATITIS C INHIBITOR PEPTIDE ANALOGS". Page/Page column 77. . Retrieved 2010/02/15.