ChemicalBook > CAS DataBase List > 3,4,5-Trifluoronitrobenzene

3,4,5-Trifluoronitrobenzene

Product Name: 3,4,5-Trifluoronitrobenzene
CAS No.: 66684-58-0
Chemical Name: 3,4,5-Trifluoronitrobenzene
Synonyms: 1,2,3-TRIFLUORO-5-NITROBENZENE;3,4,5-Trifluoronitro;5-Trifluoronitrobenzene;Pibrentasvir Impurity 17;3,4,5-TRIFLUORONITROBENZENE;5-Nitro-1,2,3-trifluorobenzene;1-NITRO-3,4,5-TRIFLUOROBENZENE;Benzene, 1,2,3-trifluoro-5-nitro-;3,4,5-Trifluoronitrobenzene, 98.5%;3,4,5-TRIFLUORO NITROBENZENE 99% MINIMUM
CBNumber: CB9427266
Molecular Formula: C6H2F3NO2
Formula Weight: 177.08
MOL File: 66684-58-0.mol

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3,4,5-Trifluoronitrobenzene Property

Boiling point:: 208.6±35.0 °C(Predicted)
Density: 1.517 g/mL at 25 °C (lit.)
refractive index: n20/D 1.486(lit.)
Flash point:: 167 °F
storage temp.: Sealed in dry,Room Temperature
form: clear liquid
color: Light yellow to Yellow to Orange
BRN: 2455018
InChI: InChI=1S/C6H2F3NO2/c7-4-1-3(10(11)12)2-5(8)6(4)9/h1-2H
InChIKey: PTTUMBGORBMNBN-UHFFFAOYSA-N
SMILES: C1(F)=CC([N+]([O-])=O)=CC(F)=C1F
CAS DataBase Reference: 66684-58-0(CAS DataBase Reference)

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Safety

Hazard Codes: T,Xi
Risk Statements: 25
Safety Statements: 45
RIDADR: UN 2810 6.1/PG 3
WGK Germany: 3
Hazard Note: Irritant
HazardClass: 6.1
PackingGroup: III
HS Code: 29049090

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Danger

Hazard statements

H300Fatal if swallowed

Precautionary statements

P264Wash hands thoroughly after handling.

P264Wash skin thouroughly after handling.

P301+P310IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

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N-Bromosuccinimide Price

Sigma-Aldrich

Product number: 656917
Product name: 3,4,5-Trifluoronitrobenzene
Purity: 97%
Packaging: 25g
Price: $707
Updated: 2023/06/20

Sigma-Aldrich

Product number: 656917
Product name: 3,4,5-Trifluoronitrobenzene
Purity: 97%
Packaging: 5g
Price: $148
Updated: 2023/01/07

TCI Chemical

Product number: T2357
Product name: 3,4,5-Trifluoronitrobenzene
Purity: >98.0%(GC)
Packaging: 5g
Price: $41
Updated: 2025/07/31

TCI Chemical

Product number: T2357
Product name: 3,4,5-Trifluoronitrobenzene
Purity: >98.0%(GC)
Packaging: 25g
Price: $126
Updated: 2025/07/31

TRC

Product number: T896425
Product name: 3,4,5-Trifluoronitrobenzene
Packaging: 5g
Price: $60
Updated: 2021/12/16

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3,4,5-Trifluoronitrobenzene Chemical Properties,Usage,Production

Chemical Properties

Colorless liquid

Uses

3,4,5-Trifluoronitrobenzene is a nitrobenzene derivative that has been shown to be stable in the environment. 3,4,5-Trifluoronitrobenzene has been detected in environmental samples and is considered to be a potential pollutant. This compound is not expected to bioaccumulate significantly due to its low water solubility. The liquid crystal properties of 3,4,5-trifluoronitrobenzene are also studied for potential application in display technologies.

Synthesis

148416-38-0

66684-58-0

The general procedure for the synthesis of 3,4,5-trifluoronitrobenzene from 2,3,4-trifluoro-6-nitroaniline was as follows: a solution of tert-butyl nitrite (340 mL) in N,N-dimethylformamide (DMF, 150 mL) was slowly added to a stirred solution of DMF (1 L) containing 6-nitro-2,3,4-trifluoroaniline (500 g). The reaction was carried out at 45-75 °C for 3 h under argon protection. After keeping the same temperature and continuing stirring for 1 h, the reaction mixture was treated with 20% aqueous hydrochloric acid solution (2 L). After cooling, steam distillation of the resulting solution gave 3,4,5-trifluoronitrobenzene as a yellow liquid, which was separated from the distillate (289 g, 62% yield). The purity of the resulting product was about 90% by gas chromatography (GC) analysis.1H NMR (δ): 8.13-7.92 (m, 2H).

References

[1] Patent: WO2004/37765, 2004, A1. Location in patent: Page 7; 8-9

3,4,5-Trifluoronitrobenzene Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 3,4,5-Trifluoronitrobenzene manufacturers

Henan Fengda Chemical Co., Ltd

Product: 3,4,5-Trifluoronitrobenzene 66684-58-0
Price: US $35.00-1.20/kg
Min. Order: 1kg
Purity: 99%
Supply Ability: g-kg-tons, free sample is available
Release date: 2024-04-17

Career Henan Chemical Co

Product: 3,4,5-Trifluoronitrobenzene 66684-58-0
Price: US $1.00/g
Min. Order: 200KG
Purity: 99%
Supply Ability: 2tons
Release date: 2019-12-19

66684-58-0, 3,4,5-TrifluoronitrobenzeneRelated Search:

Sodium 3-nitrobenzenesulphonate 2,6-Difluoronitrobenzene 3,4-Difluoronitrobenzene 4-Nitrobenzoic acid 4-Fluoronitrobenzene 4-Bromo-1-fluoro-2-nitrobenzene 3-Chloro-4-fluoronitrobenzene 1-Fluoro-2-nitrobenzene PENTAFLUORONITROBENZENE 2,3,4,5-Tetrafluoronitrobenzene 2,3,4,5-TETRAFLUORO-6-NITROBENZOIC ACID 2,3-Difluoro-6-nitroanisole 2,3,4-Trifluoro-6-nitroaniline 1,3-Dinitrobenzene NITROGEN DIOXIDE Nitrobenzene 2,3,4-Trifluoronitrobenzene 99%,2,3,4-TRIFLUORONITROBENZENE,2,3,4-Trifluoronitrobenzene99% 2,4,6-TRINITROBENZENESULFONIC ACID

1,2,3-TRIFLUORO-5-NITROBENZENE

3,4,5-TRIFLUORONITROBENZENE

1-NITRO-3,4,5-TRIFLUOROBENZENE

3,4,5-TRIFLUORO NITROBENZENE 99% MINIMUM

1,2,3-Trifluoro-5-nitrobenzene, 1-Nitro-3,4,5-trifluorobenzene

3,4,5-Trifluoronitro

5-Trifluoronitrobenzene

5-Nitro-1,2,3-trifluorobenzene

3,4,5-Trifluoronitrobenzene, 98.5%

Benzene, 1,2,3-trifluoro-5-nitro-

3,4,5-Trifluoronitrobenzene ISO 9001：2015 REACH

Pibrentasvir Impurity 17

66684-58-0

Building Blocks

Nitro Compounds

Nitrogen Compounds

Organic Building Blocks

Fluorobenzene

API intermediates

Miscellaneous

Benzenes

Fluorobenzene Series