2-Chloro-4-nitro-1-(trifluoromethyl)benzene

Basic Information

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CAS Number

151504-80-2

Molecular Formula

C7H3ClF3NO2

Molecular Weight

225.55 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

247.4°C at 760 mmHg

Flash Point

103.4°C

Refractive Index

1.493

SMILES

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C1=CC(=C(C=C1[N+](=O)[O-])Cl)C(F)(F)F

InChI

InChI=1S/C7H3ClF3NO2/c8-6-3-4(12(13)14)1-2-5(6)7(9,10)11/h1-3H

InChIKey

MOTWHSMEZCFDOD-UHFFFAOYSA-N

LogP

3.79020

Complexity

228

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

2-Chloro-4-nitro-1-trifluoromethylbenzene
J-008814
151504-80-2
AKOS015890297
3-Chloro-4-trifluoromethyl-nitrobenzene
SCHEMBL3630624
Benzene, 2-chloro-4-nitro-1-(trifluoromethyl)-
FT-0643473
CS-W006360
DS-17017
2-chloro-4-nitro-1-(trifluoromethyl)benzene
AM62315
2-Chloro-4-nitrobenzotrifluoride
EN300-53356
AC-28591
MOTWHSMEZCFDOD-UHFFFAOYSA-N
LDOYUTBEPIBKFX-UHFFFAOYSA-N
MFCD00171532
A809183
DTXSID00381220
2-Chloro-4-nitro-1-(trifluoromethyl)benzene
2-Chloro-4-nitro-1-(trifluoromethyl)benzene, 3-Chloro-4-(trifluoromethyl)nitrobenzene
PubChem4852
PC0322
SBB064778
FCH1322838
3-Chloro-4-trifluoromethyl-nitrobenze

MDL Number

MFCD00171532

Customs Code

2904909090

FAQ

What are the physical and chemical properties of 2-Chloro-4-nitro-1-(trifluoromethyl)benzene (CAS: 151504-80-2)?

2-Chloro-4-nitro-1-(trifluoromethyl)benzene is a crystalline solid with a molecular weight of approximately 266.01 g/mol. It is slightly soluble in water but more soluble in organic solvents like ethanol and acetone. This compound is known for its high reactivity, particularly towards nucleophilic substitution and electrophilic aromatic substitution reactions.

How is 2-Chloro-4-nitro-1-(trifluoromethyl)benzene (CAS: 151504-80-2) typically synthesized?

2-Chloro-4-nitro-1-(trifluoromethyl)benzene is typically synthesized via the nitration of 2-chloro-1-(trifluoromethyl)benzene followed by chlorination. Commonly, sulfuric acid and nitric acid are used as the nitrating mixture, while thionyl chloride is employed for chlorination. The reaction conditions must be carefully controlled to achieve high yield and selectivity.

What industries use 2-Chloro-4-nitro-1-(trifluoromethyl)benzene (CAS: 151504-80-2)?

2-Chloro-4-nitro-1-(trifluoromethyl)benzene is used in the pharmaceutical industry as an intermediate for the synthesis of certain drugs. It also finds applications in polymer manufacturing, where its unique properties contribute to the development of advanced materials. Additionally, it is utilized in the production of sensors and semiconductors due to its electronic and structural characteristics.

What precautions should be taken when handling 2-Chloro-4-nitro-1-(trifluoromethyl)benzene (CAS: 151504-80-2)?

When handling 2-Chloro-4-nitro-1-(trifluoromethyl)benzene, it is essential to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. The compound should be handled in a well-ventilated area or within a fume hood to minimize exposure. In case of a spill, it should be cleaned up using appropriate safety measures, and the incident should be reported to the safety department. Always refer to the Safety Data Sheet (SDS) for detailed handling instructions and emergency procedures.