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1017778-05-0

2-METHYL-5-(TRIFLUOROMETHYL)PHENOL, with the molecular formula C8H7F3O, is a phenolic compound characterized by the presence of a methyl and a trifluoromethyl group attached to a phenol ring. It is widely recognized for its role as an intermediate in the synthesis of various pharmaceuticals and agrochemicals, as well as for its applications in the production of fragrances, flavoring agents, and cosmetic products. However, it has also been identified as a potential environmental hazard due to its persistence and bioaccumulation potential, necessitating careful handling and disposal to mitigate its impact on human health and the environment.

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  • 1017778-05-0 Structure

  • Basic information

    1. Product Name: 2-METHYL-5-(TRIFLUOROMETHYL)PHENOL
    2. Synonyms: 2-METHYL-5-(TRIFLUOROMETHYL)PHENOL
    3. CAS NO:1017778-05-0
    4. Molecular Formula: C8H7F3O
    5. Molecular Weight: 176.1357896
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 1017778-05-0.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 199.5±35.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.279±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: 9.31±0.10(Predicted)
    10. CAS DataBase Reference: 2-METHYL-5-(TRIFLUOROMETHYL)PHENOL(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-METHYL-5-(TRIFLUOROMETHYL)PHENOL(1017778-05-0)
    12. EPA Substance Registry System: 2-METHYL-5-(TRIFLUOROMETHYL)PHENOL(1017778-05-0)

  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 1017778-05-0(Hazardous Substances Data)

1017778-05-0 Usage

Uses

Used in Pharmaceutical Industry:
2-METHYL-5-(TRIFLUOROMETHYL)PHENOL is used as a chemical intermediate for the synthesis of various pharmaceuticals, contributing to the development of new drugs and therapeutic agents. Its unique structure allows for the creation of molecules with specific biological activities, making it a valuable component in medicinal chemistry.
Used in Agrochemical Industry:
In the agrochemical sector, 2-METHYL-5-(TRIFLUOROMETHYL)PHENOL serves as a key intermediate in the production of pesticides and other crop protection agents. Its incorporation into these compounds can enhance their effectiveness in controlling pests and diseases, thereby supporting agricultural productivity.
Used in Fragrance Industry:
2-METHYL-5-(TRIFLUOROMETHYL)PHENOL is used as a key ingredient in the production of fragrances, where its distinct chemical properties contribute to the creation of unique and complex scents. Its use in this industry highlights its versatility and the broad range of applications it can support.
Used in Flavoring Industry:
2-METHYL-5-(TRIFLUOROMETHYL)PHENOL is also utilized in the flavoring industry, where it helps to develop and enhance the taste profiles of various food and beverage products. Its ability to impart specific flavor characteristics makes it an important component in the development of new and innovative flavor formulations.
Used in Cosmetic Industry:
In the cosmetic industry, 2-METHYL-5-(TRIFLUOROMETHYL)PHENOL is employed in the formulation of various cosmetic products, such as creams, lotions, and serums. Its incorporation can contribute to the product's efficacy, stability, and sensory properties, enhancing the overall consumer experience.

Check Digit Verification of cas no

The CAS Registry Mumber 1017778-05-0 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,0,1,7,7,7 and 8 respectively; the second part has 2 digits, 0 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 1017778-05:
(9*1)+(8*0)+(7*1)+(6*7)+(5*7)+(4*7)+(3*8)+(2*0)+(1*5)=150
150 % 10 = 0
So 1017778-05-0 is a valid CAS Registry Number.

1017778-05-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-methyl-5-(trifluoromethyl)phenol

1.2 Other means of identification

Product number -
Other names 3-HYDROXY-4-METHYLBENZOTRIFLUORIDE

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:1017778-05-0 SDS

1017778-05-0Upstream product

1017778-05-0Downstream Products

1017778-05-0Relevant articles and documents

Process for the functionalization of trifluoromethylbenzenes

-

, (2008/06/13)

Substituted trifluoromethylbenzenes are selectively functionalized by means of an initial metalation of the particular substrate with a metalating agent chosen from mixtures of lithium-and magnesium-alkyls and mixtures of lithium alkyls and magnesium salts and subsequent reaction of the product thus obtained with an electrophile.

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