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Home > Encyclopedia > 2-Chloro-3,5-dinitrobenzotrifluoride

2-Chloro-3,5-dinitrobenzotrifluoride

2-Chloro-3,5-dinitrobenzotrifluoride structure

2-Chloro-3,5-dinitrobenzotrifluoride 

structure
  • CAS No:

    392-95-0

  • Formula:

    C7H2ClF3N2O4

  • Chemical Name:

    2-Chloro-3,5-dinitrobenzotrifluoride

  • Synonyms:

    Benzene,2-chloro-1,5-dinitro-3-(trifluoromethyl)-;Toluene,2-chloro-α,α,α-trifluoro-3,5-dinitro-;2-Chloro-1,5-dinitro-3-(trifluoromethyl)benzene;2-Chloro-3,5-dinitrobenzotrifluoride;2-Chloro-3,5-dinitro-α,α,α-trifluorotoluene;2-Chloro-α,α,α-trifluoro-3,5-dinitrotoluene;1-Chloro-2,4-dinitro-6-(trifluoromethyl)benzene

  • Categories:

    Agrochemicals  >  Pesticide Intermediates

Description

white to light yellow crystal powder

2-Chloro-3,5-dinitrobenzotrifluoride Basic Attributes

270.55

270.55

2061156

206-883-0

DTXSID9073177

2904909090

Characteristics

91.6

2.97

white to light yellow crystal powder

1.7±0.1 g/cm3

57-59 °C

250C

126.2±25.9 °C

1.533

Insoluble in water. soluble in Chloroform, Methanol.

Safety Information

III

8

1759

3

36/37/38-34-20/21/22

26-37/39-36-45-36/37/39

CZ0525750

Xi

Irritant

P261, P264, P271, P280, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501

H315

2-Chloro-3,5-dinitrobenzotrifluoride Use and Manufacturing

Methods of Manufacturing

The preparation method is to add 2-chlorotrifluorotoluene to the nitrification kettle, start stirring, cool to 20°C, add the prepared mixed acid, and operate carefully to prevent the reaction from violently causing the material to run. Put it into the secondary nitrification kettle. The operation is the same as before. Add more concentrated mixed acid. After the reaction is completed, let it stand and separate. The material is neutralized, washed with water, filtered, dried, and recrystallized with ethanol to obtain the product.

Uses

A benzene derivative that increases mutagenic activity in the glutathione transferase mutant (C36).

Computed Properties

Molecular Weight:270.55
XLogP3:3.1
Hydrogen Bond Acceptor Count:7
Exact Mass:269.9655187
Monoisotopic Mass:269.9655187
Topological Polar Surface Area:91.6
Heavy Atom Count:17
Complexity:327
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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