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4-Hydroxy-3-(trifluoromethyl)benzaldehyde, a chemical compound with the formula C8H5F3O2, is a white to light yellow solid. It has a melting point of 89-91°C and is commonly utilized as an intermediate in the synthesis of pharmaceuticals, agrochemicals, and other organic compounds. Additionally, it serves as a building block in the development of various heterocyclic compounds. Due to its potential hazards, it is crucial to handle this chemical with care and follow proper safety precautions.

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  • 220227-98-5 Structure
  • Basic information

    1. Product Name: 4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE
    2. Synonyms: 4-Formyl-2-(trifluoromethyl)phenol, 5-Formyl-2-hydroxybenzotrifluoride;4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE
    3. CAS NO:220227-98-5
    4. Molecular Formula: C8H5F3O2
    5. Molecular Weight: 190.12
    6. EINECS: N/A
    7. Product Categories: Aromatic Aldehydes & Derivatives (substituted);pharmacetical
    8. Mol File: 220227-98-5.mol
  • Chemical Properties

    1. Melting Point: 159-163°C
    2. Boiling Point: 223.989 °C at 760 mmHg
    3. Flash Point: 89.266 °C
    4. Appearance: /
    5. Density: 1.429 g/cm3
    6. Vapor Pressure: 0.0626mmHg at 25°C
    7. Refractive Index: 1.511
    8. Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
    9. Solubility: N/A
    10. PKA: 5.79±0.43(Predicted)
    11. Sensitive: Air Sensitive
    12. CAS DataBase Reference: 4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE(CAS DataBase Reference)
    13. NIST Chemistry Reference: 4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE(220227-98-5)
    14. EPA Substance Registry System: 4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE(220227-98-5)
  • Safety Data

    1. Hazard Codes: Xi,Xn
    2. Statements: 22-36-43
    3. Safety Statements: 26-36/37
    4. WGK Germany: 3
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 220227-98-5(Hazardous Substances Data)

220227-98-5 Usage

Uses

Used in Pharmaceutical Industry:
4-Hydroxy-3-(trifluoromethyl)benzaldehyde is used as an intermediate in the synthesis of pharmaceuticals for its ability to contribute to the development of new drugs with specific therapeutic properties.
Used in Agrochemical Industry:
In the agrochemical industry, 4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE is used as an intermediate in the production of agrochemicals, potentially enhancing the effectiveness of pesticides or other agricultural chemicals.
Used in Organic Chemistry:
4-Hydroxy-3-(trifluoromethyl)benzaldehyde is used as a building block in organic chemistry for the creation of heterocyclic compounds, which are important in various chemical and pharmaceutical applications due to their diverse and complex structures.

Check Digit Verification of cas no

The CAS Registry Mumber 220227-98-5 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,2,0,2,2 and 7 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 220227-98:
(8*2)+(7*2)+(6*0)+(5*2)+(4*2)+(3*7)+(2*9)+(1*8)=95
95 % 10 = 5
So 220227-98-5 is a valid CAS Registry Number.
InChI:InChI=1/C8H5F3O2/c9-8(10,11)6-3-5(4-12)1-2-7(6)13/h1-4,13H

220227-98-5 Well-known Company Product Price

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  • Alfa Aesar

  • (H26098)  4-Hydroxy-3-(trifluoromethyl)benzaldehyde, 98%   

  • 220227-98-5

  • 250mg

  • 1225.0CNY

  • Detail
  • Alfa Aesar

  • (H26098)  4-Hydroxy-3-(trifluoromethyl)benzaldehyde, 98%   

  • 220227-98-5

  • 1g

  • 3146.0CNY

  • Detail

220227-98-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-Hydroxy-3-(trifluoromethyl)benzaldehyde

1.2 Other means of identification

Product number -
Other names 4-HYDROXY-3-(TRIFLUOROMETHYL)BENZALDEHYDE

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:220227-98-5 SDS

220227-98-5Relevant articles and documents

Synthesis of new Zn (II) complexes for photo decomposition of organic dye pollutants, industrial wastewater and photo-oxidation of methyl arenes under visible-light

Ahemed, Jakeer,Bhongiri, Yadagiri,Chetti, Prabhakar,Gade, Ramesh,Kore, Ranjith,Pasha, Jakeer,Pola, Someshwar,Rao D, Venkateshwar

, (2021/07/28)

Synthesis of new Schiff's base Zn-complexes for photo-oxidation of methyl arenes and xylenes are reported under visible light irradiation conditions. All the synthesized new ligands and Zn-complexes are thoroughly characterized with various spectral analyses and confirmed as 1:1 ratio of Zn and ligand with distorted octahedral structure. The bandgap energies of the ligands are higher than its Zn-complexes. These synthesized new Zn(II) complexes are used for the photo-fragmentation of organic dye pollutants, photodegradation of food industrial wastewater and oxidation of methyl arenes which are converted into its respective aldehydes with moderate yields under visible light irradiation. The photooxidation reaction dependency on the intensity of the visible light was also studied. With the increase in the dosage of photocatalyst, the methyl groups are oxidized to get aldehydes and mono acid products, which are also identified from LC-MS data. Finally, [Zn(PPMHT)Cl] is with better efficiency than [Zn(PTHMT)Cl] and [Zn(MIMHPT)Cl] for oxidation of methyl arenes is reported under visible-light-driven conditions.

ARYLALKYL- AND CYCLOALKYLALKYL-PIPERAZINE DERIVATIVES AND METHODS OF THEIR USE

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Page/Page column 218-219, (2008/06/13)

The present invention is directed to arylalkyl- and cycloalkylalkyl-piperazine derivatives, compositions containing these derivatives, and methods of their use for the prevention and treatment of conditions ameliorated by monoamine reuptake including, int

ALKANOL AND CYCLOALKANOL-AMINE DERIVATIVES AND METHODS OF THEIR USE

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Page/Page column 209-210, (2008/06/13)

The present invention is directed to alkanoyl and cycloalkanoyl-amine derivatives, compositions containing these derivatives, and methods of their use for the prevention and treatment of conditions ameliorated by monoamine reuptake including, inter alia,

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