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S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98 is a high-purity (98%) thioester derivative featuring a fluorinated structure, characterized by a butyrate ester with a trifluoromethyl group attached to the carbon atom. This chemical compound serves as a versatile building block in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals, and functions as a reagent in the creation of complex organic molecules.

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  • 118528-85-1 Structure
  • Basic information

    1. Product Name: S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98
    2. Synonyms: S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98;S-methyl 4,4,4-trifluoro-3-oxothio-butyrate;S-Methyl 3-oxo-4,4,4-trifluorothiobutyrate, S-Methyl 4,4,4-trifluoroacetoacetthioate
    3. CAS NO:118528-85-1
    4. Molecular Formula: C5H5F3O2S
    5. Molecular Weight: 186.1522096
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 118528-85-1.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 78-80 °C/73 mmHg(lit.)
    3. Flash Point: 49 °C
    4. Appearance: /
    5. Density: 1.352 g/mL at 25 °C(lit.)
    6. Refractive Index: n20/D 1.472(lit.)
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98(CAS DataBase Reference)
    10. NIST Chemistry Reference: S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98(118528-85-1)
    11. EPA Substance Registry System: S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98(118528-85-1)
  • Safety Data

    1. Hazard Codes: C
    2. Statements: 10-34
    3. Safety Statements: 16-23-26-27-36/37/39-45
    4. RIDADR: 2924
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: 3.2
    8. PackingGroup: III
    9. Hazardous Substances Data: 118528-85-1(Hazardous Substances Data)

118528-85-1 Usage

Uses

Used in Pharmaceutical Industry:
S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98 is used as a key intermediate in the synthesis of various pharmaceuticals for its ability to contribute to the development of novel drug molecules with potential therapeutic applications.
Used in Agrochemical Industry:
In the agrochemical sector, S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98 is utilized as a precursor in the production of agrochemicals, aiding in the creation of compounds that can enhance crop protection and yield.
Used in Organic Synthesis:
S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98 is employed as a building block in organic synthesis, providing a foundation for the preparation of a wide range of fine chemicals that have diverse applications across various industries.
Used as a Research Reagent:
Due to its high purity, S-METHYL 4,4,4-TRIFLUORO-3-OXOTHIO-BUTYR ATE, 98 is used as a reagent in advanced chemical research, particularly in processes that demand stringent quality standards for the production of complex organic molecules.

Check Digit Verification of cas no

The CAS Registry Mumber 118528-85-1 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,8,5,2 and 8 respectively; the second part has 2 digits, 8 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 118528-85:
(8*1)+(7*1)+(6*8)+(5*5)+(4*2)+(3*8)+(2*8)+(1*5)=141
141 % 10 = 1
So 118528-85-1 is a valid CAS Registry Number.

118528-85-1SDS

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 S-methyl 4,4,4-trifluoro-3-oxobutanethioate

1.2 Other means of identification

Product number -
Other names S-methyl 4,4,4-trifluoro-3-oxothiobutyrate

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:118528-85-1 SDS

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