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3,5-Difluorobenzotrifluoride, also known as 1,2-difluoro-3,5-dinitrobenzene, is a colorless liquid chemical compound with the molecular formula C7H3F5. It is recognized for its high reactivity and versatility, making it a valuable intermediate in the synthesis of various organic compounds, including pharmaceuticals, agrochemicals, and advanced materials.

401-85-4

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401-85-4 Usage

Uses

Used in Pharmaceutical Industry:
3,5-Difluorobenzotrifluoride is used as a key intermediate for the synthesis of pharmaceuticals, contributing to the development of new drugs with improved efficacy and safety profiles.
Used in Agrochemical Industry:
In the agrochemical sector, 3,5-Difluorobenzotrifluoride serves as a building block for the production of agrochemicals, enhancing crop protection and yield.
Used in Advanced Materials Industry:
3,5-Difluorobenzotrifluoride is utilized in the creation of advanced materials, such as polymers and coatings, due to its unique chemical properties that impart specific characteristics to the final products.
Used as a Solvent:
3,5-Difluorobenzotrifluoride also finds application as a solvent in various chemical processes, facilitating reactions and improving the efficiency of production methods.
However, it is crucial to handle 3,5-Difluorobenzotrifluoride with care due to its flammable nature and potential to cause skin and eye irritation. Additionally, it may have detrimental effects on aquatic life and the environment, necessitating proper safety measures and disposal practices.

Check Digit Verification of cas no

The CAS Registry Mumber 401-85-4 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 4,0 and 1 respectively; the second part has 2 digits, 8 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 401-85:
(5*4)+(4*0)+(3*1)+(2*8)+(1*5)=44
44 % 10 = 4
So 401-85-4 is a valid CAS Registry Number.
InChI:InChI=1/C7H3F5/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H

401-85-4SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,3-difluoro-5-(trifluoromethyl)benzene

1.2 Other means of identification

Product number -
Other names 1,3-difluoro-5-trifluoromethyl-benzene

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:401-85-4 SDS

401-85-4Relevant academic research and scientific papers

Deoxofluorination of (Hetero)aromatic Acids

Alekseenko, Anatoliy N.,Bugera, Maksym Ya.,Gerus, Igor I.,Kiriakov, Oleksandr,Klipkov, Anton A.,Mykhailiuk, Pavel K.,Pustovit, Yurii,Razhyk, Bohdan,Semenov, Sergey,Starova, Viktoriia S.,Tananaiko, Oksana Yu.,Tarasenko, Karen,Tolmachev, Andrei A.,Trofymchuk, Serhii,Zaporozhets, Olga A.

, p. 3110 - 3124 (2020/03/23)

Diverse trifluoromethyl-substituted compounds were synthesized by deoxofluorination of cinnamic and (hetero)aromatic carboxylic acids with sulfur tetrafluoride. The obtained products were used as starting materials in the preparation of novel fluorinated amino acids, anilines, and aliphatic amines - valuable building blocks for medicinal chemistry and agrochemistry.

Fluoroform-derived CuCF3 for low-cost, simple, efficient, and safe trifluoromethylation of aryl boronic acids in air

Novak, Petr,Lishchynskyi, Anton,Grushin, Vladimir V.

supporting information; experimental part, p. 7767 - 7770 (2012/08/29)

Easy does it: Aryl boronic acids undergo smooth and selective trifluoromethylation with low-cost fluoroform-derived CuCF3 in DMF in non-dried air. The reaction occurs under mild conditions (1 atm, room temperature), exhibits unprecedented funct

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