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Home > Encyclopedia > 1-Chloro-2-methyl-4-nitrobenzene

1-Chloro-2-methyl-4-nitrobenzene

1-Chloro-2-methyl-4-nitrobenzene structure

1-Chloro-2-methyl-4-nitrobenzene 

structure
  • CAS No:

    13290-74-9

  • Formula:

    C7H6ClNO2

  • Chemical Name:

    1-Chloro-2-methyl-4-nitrobenzene

  • Synonyms:

    Benzene,1-chloro-2-methyl-4-nitro-;Toluene,2-chloro-5-nitro-;1-Chloro-2-methyl-4-nitrobenzene;4-Chloro-3-methylnitrobenzene;2-Chloro-5-nitrotoluene;2-Methyl-4-nitrochlorobenzene;6-Chloro-3-nitrotoluene;2-Methyl-4-nitro-1-chlorobenzene;1-Chloro-4-nitro-2-methylbenzene

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

white to light yellow crystal powder

1-Chloro-2-methyl-4-nitrobenzene Basic Attributes

171.58

171.58

236-306-8

DTXSID8065402

2904909090

Characteristics

45.8

3.3

Transparent crystal

1.3246 (rough estimate)

42.5 °C

249 °C

94-96°C/4mm

1.5377 (estimate)

0.0212mmHg at 25°C

Safety Information

III

6.1

UN 3457 6.1/PG 3

3

6.1

22-36/37-61

Xn,N

P261, P264, P270, P271, P273, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P501

H302

|Warning|H302 (98.08%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, and P501|Aggregated GHS information provided by 52 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

1-Chloro-2-methyl-4-nitrobenzene Use and Manufacturing

Methods of Manufacturing

Take 152kg of 2-amino-5-nitrotoluene, dissolve it in 600kg of concentrated sulfuric acid, add 150kg of water, and naturally heat up to100 ° C, After all the 2-amino-5-nitrotoluene is dissolved, the temperature is lowered to 0 ° C.Adding 300 kg of industrial hydrochloric acid with a mass concentration of 30percent, keeping the temperature of the reaction solution not exceeding 0 ° C during the addition, adding 276 kg of 25percent sodium nitrite solution at a constant rate to obtain a diazonium salt solution;Adding 450 kg of industrial hydrochloric acid to another reactor, 225 kg of cuprous chloride was dissolved under stirring, and the temperature was lowered to below 20 ° C after dissolution. The diazonium salt solution was quickly added to the reaction vessel for rapid stirring and hydrolysis. After 2 hours of heat preservation, the temperature was raised to 55 ° C and the temperature was kept for 2 hours.The temperature was raised and the water vapor was distilled off to 160 kg of 2-chloro-5-nitrotoluene, and the yield was 93.3percent.

Benzene, 1-chloro-2-methyl-4-nitro-: INACTIVE

Computed Properties

Molecular Weight:171.58
XLogP3:3.3
Hydrogen Bond Acceptor Count:2
Exact Mass:171.0087061
Monoisotopic Mass:171.0087061
Topological Polar Surface Area:45.8
Heavy Atom Count:11
Complexity:157
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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