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2,4-Bis(trifluoromethyl)benzaldehyde, with the chemical formula C9H4F6O, is a white to light yellow crystalline solid. It is a versatile building block in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals. 2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE is also utilized as an intermediate in the production of dyes, fragrances, and specialty chemicals. Characterized by a strong aromatic odor, it is insoluble in water but readily soluble in organic solvents. Due to its potential health hazards and reactivity, it is crucial to handle 2,4-Bis(trifluoromethyl)benzaldehyde with appropriate safety measures.

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  • 59664-42-5 Structure
  • Basic information

    1. Product Name: 2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE
    2. Synonyms: 2,4-Bis(trifluoromethyl)benzaldehyde98%;2,4-Bis(trifluoromethyl;2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE;2,4-DI(TRIFLUOROMETHYL)BENZALDEHYDE;2,4-Bis(trifluoromethyl)benzaldehyde 98%
    3. CAS NO:59664-42-5
    4. Molecular Formula: C9H4F6O
    5. Molecular Weight: 242.12
    6. EINECS: N/A
    7. Product Categories: Aromatic Aldehydes & Derivatives (substituted);Benzene series;Benzaldehyde;Aldehydes;C9;Carbonyl Compounds;Fluorine series
    8. Mol File: 59664-42-5.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 172 °C(lit.)
    3. Flash Point: 155 °F
    4. Appearance: clear, colorless to pale yellow liquid
    5. Density: 1.48 g/mL at 25 °C(lit.)
    6. Vapor Pressure: 0.409mmHg at 25°C
    7. Refractive Index: n20/D 1.422(lit.)
    8. Storage Temp.: 0-10°C
    9. Solubility: N/A
    10. Sensitive: Air Sensitive
    11. CAS DataBase Reference: 2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE(CAS DataBase Reference)
    12. NIST Chemistry Reference: 2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE(59664-42-5)
    13. EPA Substance Registry System: 2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE(59664-42-5)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: 36/37/38
    3. Safety Statements: 26-36
    4. WGK Germany: 3
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 59664-42-5(Hazardous Substances Data)

59664-42-5 Usage

Uses

Used in Pharmaceutical Industry:
2,4-Bis(trifluoromethyl)benzaldehyde is used as a key building block for the synthesis of various pharmaceuticals. Its unique structure and properties make it a valuable component in the development of new drugs with specific therapeutic effects.
Used in Agrochemical Industry:
In the agrochemical sector, 2,4-Bis(trifluoromethyl)benzaldehyde serves as an intermediate in the production of agrochemicals. Its incorporation into these products contributes to the effectiveness of pesticides and other agricultural chemicals.
Used in Dye Production:
2,4-Bis(trifluoromethyl)benzaldehyde is used as an intermediate in the synthesis of dyes. Its chemical properties allow for the creation of dyes with specific color characteristics and stability.
Used in Fragrance Industry:
2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE is also utilized in the fragrance industry as an intermediate for creating unique and long-lasting scents. Its aromatic properties contribute to the development of novel fragrances.
Used in Specialty Chemicals Production:
2,4-Bis(trifluoromethyl)benzaldehyde is employed as an intermediate in the production of specialty chemicals, which are used in various applications such as coatings, adhesives, and plastics. Its versatility and chemical properties make it an essential component in these industries.

Check Digit Verification of cas no

The CAS Registry Mumber 59664-42-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,9,6,6 and 4 respectively; the second part has 2 digits, 4 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 59664-42:
(7*5)+(6*9)+(5*6)+(4*6)+(3*4)+(2*4)+(1*2)=165
165 % 10 = 5
So 59664-42-5 is a valid CAS Registry Number.
InChI:InChI=1/C6H2Br3F9/c7-1-2(8,9)3(10,11)4(12,13)5(14,15)6(16,17)18/h1H2

59664-42-5 Well-known Company Product Price

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  • Alfa Aesar

  • (B20978)  2,4-Bis(trifluoromethyl)benzaldehyde, 97%   

  • 59664-42-5

  • 1g

  • 413.0CNY

  • Detail
  • Alfa Aesar

  • (B20978)  2,4-Bis(trifluoromethyl)benzaldehyde, 97%   

  • 59664-42-5

  • 5g

  • 1319.0CNY

  • Detail

59664-42-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,4-BIS(TRIFLUOROMETHYL)BENZALDEHYDE

1.2 Other means of identification

Product number -
Other names 2,4-trifluoromethylbenzaldehyde

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:59664-42-5 SDS

59664-42-5Relevant articles and documents

An aerobic oxidation of alcohols into carbonyl synthons using bipyridyl-cinchona based palladium catalyst

Cheedarala, Ravi Kumar,Chidambaram, Ramasamy R.,Siva, Ayyanar,Song, Jung Il

, p. 32942 - 32954 (2021/12/02)

We have reported an aerobic oxidation of primary and secondary alcohols to respective aldehydes and ketones using a bipyridyl-cinchona alkaloid based palladium catalytic system (PdAc-5) using oxygen at moderate pressure. ThePdAc-5catalyst was analysed using SEM, EDAX, and XPS analysis. The above catalytic system is used in experiments for different oxidation systems which include different solvents, additives, and bases which are cheap, robust, non-toxic, and commercially available on the industrial bench. The obtained products are quite appreciable in both yield and selectivity (70-85%). In addition, numerous important studies, such as comparisons with various commercial catalysts, solvent systems, mixture of solvents, and catalyst mole%, were conducted usingPdAc-5. The synthetic strategy of oxidation of alcohol into carbonyl compounds was well established and all the products were analysed using1H NMR,13CNMR and GC-mass analyses.

Rhodium-catalyzed reductive carbonylation of aryl iodides to arylaldehydes with syngas

Chen, Suqing,Liu, Zhenghui,Mu, Tiancheng,Wang, Peng,Yan, Zhenzhong,Yu, Dongkun,Zhao, Xinhui

, p. 645 - 656 (2020/05/14)

The reductive carbonylation of aryl iodides to aryl aldehydes possesses broad application prospects. We present an efficient and facile Rh-based catalytic system composed of the commercially available Rh salt RhCl3·3H2O, PPh3 as phosphine ligand, and Et3N as the base, for the synthesis of arylaldehydes via the reductive carbonylation of aryl iodides with CO and H2 under relatively mild conditions with a broad substrate range affording the products in good to excellent yields. Systematic investigations were carried out to study the experimental parameters. We explored the optimal ratio of Rh salt and PPh3 ligand, substrate scope, carbonyl source and hydrogen source, and the reaction mechanism. Particularly, a scaled-up experiment indicated that the catalytic method could find valuable applications in industrial productions. The low gas pressure, cheap ligand and low metal dosage could significantly improve the practicability in both chemical researches and industrial applications.

Process for producing trifluoromethylbenzylamines

-

, (2008/06/13)

The present invention relates to a process for producing a trifluoromethylbenzylamine represented by the general formula (1). This process includes the step of reducing an oxime represented by the general formula (2), where R1represents hydrogen atom, a halogen atom selected from the group consisting of fluorine, chlorine, bromine and iodine, or trifluoromethyl group, where R1is defined as above, and R2represents hydrogen atom, an alkyl group or an aralkyl group. With this process, the trifluoromethylbenzylamine can be produced with high selectivity.

Heterocyclic pesticidal compounds

-

, (2008/06/13)

Compounds of the formula (I) STR1 which contain between 10 and 27 carbon atoms, and wherein m and n are independently selected from 0, 1 and 2; R2a is hydrogen, methyl, or ethyl; R2b is acetylene or contains between 3 and 18 carbon atoms and is a group R7, wherein R7 is a C1-13 non-aromatic hydrocarbyl group, optionally substituted by a cyano or C1-4 carbalkoxy group and/or by one or two hydroxy groups and/or by one to five halo atoms which are the same or different and/or by one to three groups R8 which are the same or different and each contain one to four hetero atoms, which are the same or different and are chosen from oxygen, sulphur, nitrogen and silicon, 1 to 10 carbon atoms and optionally 1 to 6 fluoro or chloro atoms or R2b is a 6-membered aromatic ring substituted by cyano and/or by one to three groups R8 and/or by a group --C CH, --C C-R7 or C C-halo and/or by one to five halo atoms and/or by one to three C1-4 haloalkyl groups wherein R7 and R8 are as hereinbefore defined; R4 and R6 are the same or different and are chosen from hydrogen, methyl, trifluoromethyl or cyano; and R5 is hydrogen or methyl provided that R2b is not propyl or butyl are described which have pesticidal activity, particularly against arthropod pests. Pesticidal formulations containing the compounds of the formula (I), their use in the control of pests and method for their preparation are also disclosed.

Process for lithiation of 1,3-bis(trifluoromethyl)benzene

-

, (2008/06/13)

A novel process for the lithiation of 1,3-bis(trifluoro-methyl)benzene in a solvent is described, said process comprising carrying out the lithiation with the lithium salt of an amine of the general formula wherein R1 and R2 are secondary or tertiary lower alkyl or secondary or tertiary lower alkyl substituted by a lower alkyl or lower cycloalkyl or lower cycloaklyl substituted by a lower alkyl, or R1 and R2 taken together form a C6-14 -alkylene group in which the two carbon atoms linked with the nitrogen atom are secondary or tertiary and are separated from each other by 2 to 4 carbon atoms. The solution of the lithiated 1,3-bis(trifluoromethyl)-benzene obtained can be reacted with an electrophile which is suitable for the substitution of lethiated benzene derivatives, whereby a compound of the formula STR1 wherein R3 signifies the residue of an electrophile which is suitable for the substitution of lithiated benzene derivatives, is obtained.

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