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CAS

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758-42-9

1,1,1-Trichlorotrifluoroacetone, also known as trifluoroacetyl chloride, is a colorless, volatile liquid with a pungent odor. It is a highly reactive chemical compound that is primarily used as a reagent in organic synthesis and as a solvent in chemical reactions. Due to its reactivity and potential for harmful health effects, including irritation to the eyes, skin, and respiratory system, as well as central nervous system depression, it is important to handle this chemical with caution and ensure proper safety measures are in place when working with it. Additionally, it is considered environmentally hazardous and should be handled and disposed of properly to prevent harm to the environment.

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  • 758-42-9 Structure

  • Basic information

    1. Product Name: 1,1,1-TRICHLOROTRIFLUOROACETONE
    2. Synonyms: 1,1,1-trichloro-3,3,3-trifluoroacetone;1,1,1-Trichlorotrifluoroacetone 97%;1,1,1-Trichlorotrifluoroacetone97%;1,1,1-Trifluoro-3,3,3-trichlorpropan-2-one;1,1,1-Trichloro-3,3,3-trifluoro-2-propanone;2,4,6-Trichlorothiophenol;1,1,1-Trichloro-3,3,3-trifluoroacetone 97%;1,1,1-Trichloro-3,3,3-trifluoropropan-2-one, 2-Oxo-1,1,1-trichloro-3,3,3-trifluoropropane
    3. CAS NO:758-42-9
    4. Molecular Formula: C3Cl3F3O
    5. Molecular Weight: 215.39
    6. EINECS: 212-063-3
    7. Product Categories: N/A
    8. Mol File: 758-42-9.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 86 °C
    3. Flash Point: 87.2 °C
    4. Appearance: /
    5. Density: 1,6 g/cm3
    6. Vapor Pressure: 1.46mmHg at 25°C
    7. Refractive Index: 1.381
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 1,1,1-TRICHLOROTRIFLUOROACETONE(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1,1,1-TRICHLOROTRIFLUOROACETONE(758-42-9)
    12. EPA Substance Registry System: 1,1,1-TRICHLOROTRIFLUOROACETONE(758-42-9)

  • Safety Data

    1. Hazard Codes: C
    2. Statements: 34-36/37/38
    3. Safety Statements: 26-36/37/39
    4. RIDADR: 3265
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: CORROSIVE
    8. PackingGroup: N/A
    9. Hazardous Substances Data: 758-42-9(Hazardous Substances Data)

758-42-9 Usage

Uses

Used in Organic Synthesis:
1,1,1-Trichlorotrifluoroacetone is used as a reagent in organic synthesis for its high reactivity, enabling the formation of various chemical compounds.
Used in Chemical Reactions as a Solvent:
1,1,1-Trichlorotrifluoroacetone is used as a solvent in chemical reactions to facilitate the process and improve the efficiency of the reaction.
Used in Pharmaceutical Production:
1,1,1-Trichlorotrifluoroacetone is used as a starting material in the production of pharmaceuticals, contributing to the synthesis of various medicinal compounds.
Used in Agrochemical Production:
1,1,1-Trichlorotrifluoroacetone is used as a starting material in the production of agrochemicals, aiding in the synthesis of compounds used in agriculture.
Used in Specialty Chemicals Production:
1,1,1-Trichlorotrifluoroacetone is used as a starting material in the production of specialty chemicals, enabling the creation of unique and specific chemical products.

Check Digit Verification of cas no

The CAS Registry Mumber 758-42-9 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 7,5 and 8 respectively; the second part has 2 digits, 4 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 758-42:
(5*7)+(4*5)+(3*8)+(2*4)+(1*2)=89
89 % 10 = 9
So 758-42-9 is a valid CAS Registry Number.
InChI:InChI=1/C8H5F5O/c1-2(14)3-4(9)6(11)8(13)7(12)5(3)10/h2,14H,1H3

758-42-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,1,1-trichloro-3,3,3-trifluoropropan-2-one

1.2 Other means of identification

Product number -
Other names 3,3,3-trichloro-1,1,1-trifluoroacetone

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:758-42-9 SDS

758-42-9Relevant articles and documents

Reductive alkylation of perfluorocarboxylic acid esters with CCl 3F or CCl4 and synthesis of higher linear perfluoroketones

Zeifman, Yu.V.,Postovoi

, p. 1815 - 1819 (2007/10/03)

Barbier-type reductive alkylation of perfluorocarboxylic acid esters (I) with CFCl3 and activated Al was successfully performed to give α,α-dichloroperfluoroketones (II). A similar reaction of CF 3COOEt with CCl4 and Al provided a convenient synthesis of CF3COCCl3. Ketones (II) were fluorinated further with SbF5 to form higher linear perfluoroketones (IX). An alternative approach to the synthesis of ketones (IX) was proposed by reductive perfluoroalkylation of esters (I) under the action of RFI and Al.

Synthetic application of 3,3-dichloro-1, 1, 1-trifluoroacetone (DCTFA) and 3,3,3-trichloro-1, 1, 1-trifluoroacetone (TCTFA) for trifluorolactic acid derivatives

Ishii, Akihiro,Kanai, Masatomi,Yasumoto, Manabu,Inomiya, Kenjin,Kuriyama, Yokusu,Katsuhara, Yutaka

, p. 567 - 571 (2007/10/03)

Synthetic application of 3,3-dichloro-1,1,1-trifluoroacetone (DCTFA) and 3,3,3-trichloro-1,1,1-trifluoroacetone (TCTFA) for industrially important trifluorolactic acid derivatives is described. Trifluorolactic acid was obtained by hydrolysis of DCTFA unde

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