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879-39-0

Basic Information
CAS No.: 879-39-0
Name: 2,3,4,5-Tetrachloronitrobenzene
Article Data: 10
Molecular Structure:
Molecular Structure of 879-39-0 (2,3,4,5-Tetrachloronitrobenzene)
Formula: C6H Cl4 N O2
Molecular Weight: 260.891
Synonyms: 1,2,3,4-Tetrachloro-5-nitrobenzene;1-Nitro-2,3,4,5-tetrachlorobenzene; 2,3,4,5-Tetrachloro-1-nitrobenzene; NSC5577; NSC 57752
EINECS: 212-906-5
Density: 1.75g/cm3
Melting Point: 65°C
Boiling Point: 315.2oC at 760 mmHg
Flash Point: 144.4oC
Solubility: 7.305mg/L(20 oC)
Appearance: Pale yellow to green crystalline solid.
Hazard Symbols:
Risk Codes: 20/21/22-36/37/38
Safety: Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition it emits very toxic fumes of Cl and NOx. See also NITRO COMPOUNDS of AROMATIC HYDROCARBONS.
PSA: 45.82000
LogP: 4.73160
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Chemistry

IUPAC Name: 1,2,3,4-Tetrachloro-5-nitrobenzene
Synonyms: 1,2,3,4-Tetrachloro-5-nitrobenzene ; Benzene, 1,2,3,4-tetrachloro-5-nitro- ; 1-Nitro-2,3,4, 5-tetrachlorobenzene ; 1-Nitro-2,3,4,5-tetrachlorobenzene
Product Categories: Alpha sort;Pesticides&Metabolites;Q-ZAlphabetic;TA - TE
CAS NO:879-39-0
Molecular Formula of 1,2,3,4-Tetrachloro-5-nitrobenzene (CAS NO.879-39-0) :C6HCl4NO2
Molecular Weight of 1,2,3,4-Tetrachloro-5-nitrobenzene (CAS NO.879-39-0) :260.89
Molecular Structure of 1,2,3,4-Tetrachloro-5-nitrobenzene (CAS NO.879-39-0) :
EINECS: 212-906-5
Index of Refraction:1.62
Surface Tension: 55.1 dyne/cm
Density: 1.75 g/cm3
Flash Point: 144.4 °C
Enthalpy of Vaporization: 53.42 kJ/mol
Boiling Point: 315.2 °C at 760 mmHg
Vapour Pressure: 0.000822 mmHg at 25°C
Melting point: 65°C
Appearance:Pale yellow crystals

Uses

2,3,4,5 - Tetrachloro-nitrobenzene used in the synthesis of intermediate 2,4 - difluoro-3,5 - dichloro-nitrobenzene of pesticides fluorophenyl urea .

Production

Preparation Products :Teflubenzuron-->2,4-Difluoro-3,5-dichloronitrobenzene
Raw materials : Chlorosulfonic acid-->1,2,4-Trichloro-5-nitrobenzene 
 1,2,3,4-Tetrachloro-5-nitrobenzene (CAS NO.879-39-0) is obtained by chlorination of the 2,4,5 - Trichloro-nitrobenzene .
In the reactor, adding a certain amount of 2,4,5 - Trichloro-nitrobenzene and Chlorine acid, which leads to Chlorine, temperature controlled at (60 ± 10)°C, reaction about 10h, the reaction process, thin Layer Chromatography tracking response.After reaction,pouring a large number of ice water after, put it aside, filtration, recrystallization with petroleum ether, after drying, 2,3,4,5 - Tetrachloro-nitrobenzene is obatined.

Safety Profile

Questionable carcinogen with experimental neoplastigenic data. When heated to decomposition it emits very toxic fumes of Cl and NOx. See also NITRO COMPOUNDS of AROMATIC HYDROCARBONS.
Hazard Codes HarmfulXn
Risk Statements 20/21/22-36/37/38
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed. 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements 26-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
RTECS DB9625000

Specification

2,3,4,5-Tetrachloronitrobenzene will behave as a weak oxidizer, and will react with strong reducing agents including hydrides, sulfides and nitrides.