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

Basic Information

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CAS Number

367-86-2

Molecular Formula

C7H3F4NO2

Molecular Weight

209.1 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

92 °C/15 mmHg

Water Solubility

Insoluble in water.

Refractive Index

n20/D 1.462(lit.)

SMILES

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C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])F

InChI

InChI=1S/C7H3F4NO2/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14/h1-3H

InChIKey

HLDFCCHSOZWKAA-UHFFFAOYSA-N

LogP

3.27590

Complexity

225

Safety Information

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GHS Hazard Pictograms

H226

H315

H319

H335

Hazard Statement

H226 Flammable liquid and vapor
Flammable liquids

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 6.1 Class 6.1

Synonyms & References

English

EINECS 206-702-5
NIKYUPOKNFUXPQ-UHFFFAOYSA-N
4-Fluoro-3-nitrobenzotrifluoride, technical grade
1-Fluoro-4-trifluoromethyl-2-nitrobenzene
367-86-2
4-fluoro-3-nitrobenzo trifluoride
2-fluoro-5-trifluoromethyl nitrobenzene
NS00041715
SFN4U7RYL9
EN300-18690
4-fluoro-3-nitro-benzo trifluoride
FT-0618489
D70871
2-nitro-4-trifluoromethylfluoro-benzene
Z87002576
AM61938
NSC10303
4-Fluoro-3-nitrobenzotrifluoride, 96%
Benzene, 1-fluoro-2-nitro-4-(trifluoromethyl)-
4-Fluoro-3-nitrobenzotrifluoride
A6331
DTXSID5073169
3-nitro-4-fluorobenzotrifluoride
1-Fluoro-2-nitro-4-trifluoromethyl-benzene
1-Fluoro-2-nitro-4-(trifluoromethyl)benzene #
W-106586
InChI=1/C7H3F4NO2/c8-5-2-1-4(7(9,10)11)3-6(5)12(13)14/h1-3
4-fluoro-3-nitro-benzotrifluoride
3-Nitro-alpha,alpha,alpha,4-tetrafluorotoluene
SCHEMBL5961
NSC-10303

MDL Number

MFCD00007059

Customs Code

2904909090

FAQ

What are the physical and chemical properties of 1-Fluoro-2-nitro-4-(trifluoromethyl)benzene (CAS: 367-86-2)?

1-Fluoro-2-nitro-4-(trifluoromethyl)benzene (CAS 367-86-2) is a crystalline solid with a molecular weight of approximately 266.02 g/mol. It is poorly soluble in water but soluble in common organic solvents like dichloromethane and acetonitrile. The compound is highly reactive, particularly towards nucleophilic substitution and reduction reactions.

How is 1-Fluoro-2-nitro-4-(trifluoromethyl)benzene (CAS: 367-86-2) typically synthesized?

1-Fluoro-2-nitro-4-(trifluoromethyl)benzene is typically synthesized via the nitration of 1-fluoro-4-(trifluoromethyl)benzene followed by nitration. This process involves the use of nitric acid and sulfuric acid as reagents, and the reaction is carried out under controlled conditions to ensure high selectivity and yield.

What industries use 1-Fluoro-2-nitro-4-(trifluoromethyl)benzene (CAS: 367-86-2)?

1-Fluoro-2-nitro-4-(trifluoromethyl)benzene is used in various industries, particularly in pharmaceuticals for the synthesis of drug intermediates, and in the production of sensors and semiconductors. It is also utilized in the polymer industry for the development of specialized polymers with enhanced properties.

What precautions should be taken when handling 1-Fluoro-2-nitro-4-(trifluoromethyl)benzene (CAS: 367-86-2)?

When handling 1-Fluoro-2-nitro-4-(trifluoromethyl)benzene (CAS 367-86-2), it is crucial to wear appropriate personal protective equipment (PPE), including safety goggles, gloves, and a lab coat. The compound should be handled in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up immediately using appropriate absorbents, and the material safety data sheet (MSDS/SDS) should be consulted for proper disposal and emergency response procedures.