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CAS

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29885-95-8

N-METHYLANILINIUM TRIFLUOROACETATE is a chemical compound with the appearance of white to very slightly greyish crystalline needles. It is primarily used in organic synthesis, where it functions as an α-methylating agent for ketones and activates internucleodecoupling upon removal.

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  • 29885-95-8 Structure

  • Basic information

    1. Product Name: N-METHYLANILINIUM TRIFLUOROACETATE
    2. Synonyms: TRIFLUOROACETIC ACID N-METHYLANILINE SALT;TRIFLUOROACETIC ACID N-METHYLANILINIUM SALT;TAMA;N-METHYLANILINE TRIFLUOROACETATE;N-METHYLANILINIUM TRIFLUOROACETATE;N-MATFA;N-Methylaniline trifluoroacetate salt;N-Methylaniliniumtrifluoroacetate,99%
    3. CAS NO:29885-95-8
    4. Molecular Formula: C2HF3O2*C7H9N
    5. Molecular Weight: 221.18
    6. EINECS: 249-927-4
    7. Product Categories: N/A
    8. Mol File: 29885-95-8.mol

  • Chemical Properties

    1. Melting Point: 65-66 °C(lit.)
    2. Boiling Point: 196.2°Cat760mmHg
    3. Flash Point: 78.9°C
    4. Appearance: /
    5. Density: 1.2770 (estimate)
    6. Vapor Pressure: 0.402mmHg at 25°C
    7. Refractive Index: N/A
    8. Storage Temp.: 2-8°C
    9. Solubility: Chloroform (Slightly), Methanol (Slightly)
    10. Sensitive: Hygroscopic
    11. BRN: 3638133
    12. CAS DataBase Reference: N-METHYLANILINIUM TRIFLUOROACETATE(CAS DataBase Reference)
    13. NIST Chemistry Reference: N-METHYLANILINIUM TRIFLUOROACETATE(29885-95-8)
    14. EPA Substance Registry System: N-METHYLANILINIUM TRIFLUOROACETATE(29885-95-8)

  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: 36/37/38
    3. Safety Statements: 22-24/25
    4. WGK Germany: 3
    5. RTECS:
    6. F: 1-9
    7. HazardClass: 9
    8. PackingGroup: N/A
    9. Hazardous Substances Data: 29885-95-8(Hazardous Substances Data)

29885-95-8 Usage

Uses

Used in Organic Synthesis:
N-METHYLANILINIUM TRIFLUOROACETATE is used as an α-methylating agent for ketones, which is essential for the synthesis of various organic compounds. Its ability to activate internucleodecoupling upon removal makes it a valuable reagent in this application.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, N-METHYLANILINIUM TRIFLUOROACETATE is used for the synthesis of various drugs and drug intermediates. Its role as an α-methylating agent allows for the creation of new molecular structures with potential therapeutic properties.
Used in Chemical Research:
N-METHYLANILINIUM TRIFLUOROACETATE is also utilized in chemical research, where it helps scientists understand the reactivity and behavior of different compounds. Its unique properties make it a useful tool for studying various chemical reactions and mechanisms.

Check Digit Verification of cas no

The CAS Registry Mumber 29885-95-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,9,8,8 and 5 respectively; the second part has 2 digits, 9 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 29885-95:
(7*2)+(6*9)+(5*8)+(4*8)+(3*5)+(2*9)+(1*5)=178
178 % 10 = 8
So 29885-95-8 is a valid CAS Registry Number.
InChI:InChI=1/C7H9N.C2HF3O2/c1-8-7-5-3-2-4-6-7;3-2(4,5)1(6)7/h2-6,8H,1H3;(H,6,7)

29885-95-8 Well-known Company Product Price

  • Brand
  • (Code)Product description
  • CAS number
  • Packaging
  • Price
  • Detail

  • Alfa Aesar

  • (A17781)  N-Methylanilinium trifluoroacetate, 99%   

  • 29885-95-8

  • 25g

  • 350.0CNY

  • Detail

  • Alfa Aesar

  • (A17781)  N-Methylanilinium trifluoroacetate, 99%   

  • 29885-95-8

  • 100g

  • 946.0CNY

  • Detail

  • Alfa Aesar

  • (A17781)  N-Methylanilinium trifluoroacetate, 99%   

  • 29885-95-8

  • 500g

  • 4020.0CNY

  • Detail

  • Aldrich

  • (210080)  N-Methylanilinetrifluoroacetate  99%

  • 29885-95-8

  • 210080-25G

  • 370.89CNY

  • Detail

29885-95-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl(phenyl)azanium,2,2,2-trifluoroacetate

1.2 Other means of identification

Product number -
Other names N-MethylaniliniuM Trifluoroacetate

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:29885-95-8 SDS

29885-95-8Relevant articles and documents

High-throughput approach for the identification of anilinium-based ionic liquids that are suitable for electropolymerisation

Abdelhamid, Muhammad E.,Murdoch, Timothy,Greaves, Tamar L.,O'Mullane, Anthony P.,Snook, Graeme A.

, p. 17967 - 17972 (2015/07/07)

We report the synthesis of new protic ionic liquids (PILs) based on aniline derivatives and the use of high-throughput (HT) techniques to screen possible candidates. In this work, a simple HT method was applied to rapidly screen different aniline derivatives against different acids in order to identify possible combinations that produce PILs. This was followed by repeating the HT process with a Chemspeed robotic synthesis platform for more accurate results. One of the successful combinations were then chosen to be synthesised on a larger scale for further analysis. The new PILs are of interest to the fields of ionic liquids, energy storage and especially, conducting polymers as they serve as solvents, electrolytes and monomers at the same time for possible electropolymerisation (i.e. a self-contained polymer precursor).

Efficient, direct α-methylenation of carbonyls mediated by diisopropylammonium trifluoroacetate

Bugarin, Alejandro,Jones, Kyle D.,Connell, Brian T.

supporting information; experimental part, p. 1715 - 1717 (2010/07/06)

A very efficient method for the direct α-methylenation of carbonyl compounds, with yields up to 99%, utilizing paraformaldehyde, diisopropylammonium trifluoroacetate, and catalytic acid or base, is presented.

Phosphomonoesters and phosphodiesters derived from the photohydrolysis of 2-methoxy-5-nitrophenyl substituted phosphotriesters

Graciani, Nilsa R.,Swanson, Daniel S.,Kelly, Jeffery W.

, p. 1077 - 1086 (2007/10/02)

Phosphotriesters composed of one or two 2-methoxy-5-nitrophenyl group(s) can be quantatively photohydrolyzed in aqueous acetonitrile to yield the desired phosphodiester or phosphomonoester, respectively. Photohydrolysis occurs by attack of hydroxide at both the phosphoryl phosphorus and at the ipso-carbon in the triplet exited state of the 2-methoxy-5-nitrophenyl substituted phosphoesters. The photophysical studies described within imply that this type of reaction may be synthetically useful.

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