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Phenyltrimethylammonium iodide is an organic compound with the chemical formula C9H12IN. It is a crystalline solid that is soluble in water and exhibits cationic properties. Phenyltrimethylammonium iodide is known for its unique chemical structure, which consists of a phenyl ring attached to a trimethylammonium group and an iodide ion. Its versatile nature makes it a valuable component in various applications across different industries.

98-04-4

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98-04-4 Usage

Uses

Phenyltrimethylammonium iodide is used as a reagent for the detection and determination of cadmium. It plays a crucial role in analytical chemistry, where it helps in the identification and quantification of cadmium ions in various samples, such as environmental, biological, and industrial materials.
Used in Organic Synthesis:
Phenyltrimethylammonium iodide is used as an intermediate in organic synthesis for the production of various organic compounds. Its cationic nature allows it to participate in a wide range of chemical reactions, making it a valuable building block for the synthesis of pharmaceuticals, dyes, and agrochemicals.
Used in Pharmaceuticals:
In the pharmaceutical industry, phenyltrimethylammonium iodide is used as a key intermediate in the synthesis of various drugs. Its unique structure enables it to form essential chemical bonds and contribute to the development of new and innovative medications.
Used in Dyes:
Phenyltrimethylammonium iodide is used as a raw material in the production of dyes. Its ability to form colored compounds makes it an essential component in the creation of a wide range of dyes used in various applications, such as textiles, plastics, and printing inks.
Used in Agrochemicals:
In the agrochemical industry, phenyltrimethylammonium iodide is used as an intermediate for the synthesis of various agrochemical products. Its versatility allows it to be incorporated into the development of pesticides, herbicides, and other agricultural chemicals that help improve crop yields and protect plants from pests and diseases.

Check Digit Verification of cas no

The CAS Registry Mumber 98-04-4 includes 5 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 2 digits, 9 and 8 respectively; the second part has 2 digits, 0 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 98-04:
(4*9)+(3*8)+(2*0)+(1*4)=64
64 % 10 = 4
So 98-04-4 is a valid CAS Registry Number.
InChI:InChI=1/C9H13N.HI/c1-6-4-5-9(10)8(3)7(6)2;/h4-5H,10H2,1-3H3;1H

98-04-4 Well-known Company Product Price

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  • Alfa Aesar

  • (A14402)  Phenyltrimethylammonium iodide, 99%   

  • 98-04-4

  • 25g

  • 309.0CNY

  • Detail
  • Alfa Aesar

  • (A14402)  Phenyltrimethylammonium iodide, 99%   

  • 98-04-4

  • 100g

  • 659.0CNY

  • Detail
  • Alfa Aesar

  • (A14402)  Phenyltrimethylammonium iodide, 99%   

  • 98-04-4

  • 500g

  • 3052.0CNY

  • Detail

98-04-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name Phenyltrimethylammonium Iodide

1.2 Other means of identification

Product number -
Other names Benzenaminium, N,N,N-trimethyl-, iodide

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:98-04-4 SDS

98-04-4Relevant articles and documents

A simple radiometric in vitro assay for acetylcholinesterase inhibitors

Guilarte,Burns,Dannals,Wagner Jr.

, p. 90 - 92 (1983)

A radiometric method for screening acetylcholinesterase inhibitors has been described. The method is based on the production of [14C]carbon dioxide from the hydrolysis of acetylcholine. The inhibitory concentration at 50% (IC50) values for several known acetylcholinesterase inhibitors were in agreement with literature values. The new radiometric method is simple, inexpensive, and has the potential for automation.

Molecular imaging agents

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Page/Page column 19, (2015/12/25)

Provided is radiolabeled ammonium salts and uses thereof as myocardial perfusion agents in molecular imaging.

Design and synthesis of a task-specific ionic liquid as a transducer in potentiometric sensors

Ping, Jianfeng,Wang, Yixian,Ying, Yibin,Wu, Jian

, p. 19782 - 19784 (2013/11/06)

A task-specific ionic liquid called N,N,N-trimethylaniline hexafluorophosphate was synthesized and further employed as an ion-to-electron transducer in potentiometric sensors with excellent performance. The Royal Society of Chemistry 2013.

MOLECULAR IMAGING AGENTS

-

, (2011/12/13)

Provided is radiolabeled ammonium salts and uses thereof as myocardial perfusion agents in molecular imaging.

Quaternization reaction of aromatic heterocyclic imines in methanol - A case of strong anti-reactivity selectivity principle with isoselective temperature

Alfaia, Antonio J. I.,Calado, Antonio R. T.,Reis, Joao Carlos R.

, p. 3627 - 3631 (2007/10/03)

Accurate second-order rate constants were measured at 5 °C intervals in the temperature range 20-60 °C for the Menshutkin reaction of 1-methylbenzimidazole, 2-amino-1-methylbenzimidazole and N,N-dimethylaniline with iodomethane and iodoethane in methanol. In every case a good linearity in the Eyring plots was observed. Values for the activation enthalpy and entropy are reported. Analysis in terms of Exner's redefinition of the reactivity-selectivity principle (RSP) identified the present reaction series as a case of strong anti-RSP for selectivity towards the substrate. This case is shown to represent an isoselective relationship with the isoselective temperature lower than the experimental temperatures (β(is) = -52 °C). The isokinetic relationship does not hold in the reaction series with a fixed substrate. These findings suggest an early transition state in the Menshutkin reaction of polyfunctional aromatic imines.

Nitrogen and deuterium kinetic isotope effects on the menshutkin reaction

Szylhabel-Godala,Madhavan,Rudzinski,O'Leary,Paneth

, p. 35 - 40 (2007/10/03)

Nitrogen and deuterium kinetic isotope effects were measured in the Menshutkin reaction between methyl iodide and a series of para-substituted N,N-dimethylanilines in ethanol. The nitrogen kinetic isotope effect increases for the more electron-donating substituents [0·9989, 1·0032, and 1·0036 for 4-C(O)Me, II and 4-Me, respectively], in agreement with the Hammond postulate. The secondary deuterium isotope effect, however, exhibits the reverse trend (1·045, 0·989, 0·975 per deuterium, for the respective substituents). This discrepancy is rationalized in terms of solvent molecule participation in the transition state.

Simple and Rapid Determination of the Activation Parameters of Organic Reactions by Temperature-Dependent NMR Spectroscopy I. Application to Irreversible Reactions

Satoh, Masahiro,Hirota, Minoru

, p. 2031 - 2038 (2007/10/03)

A rapid and convenient method for the evaluation of activation enthalpies and entropies of reactions in solutions was contrived. This was realized by the stepwise elevation of the temperature of a reaction system using a variable temperature apparatus of NMR spectrometer. A repetition of rapid collection of FIDs (Free Inductive Decays) at every plateau part of temperature at regular intervals allows us to determine the time-conversion curve, from which the rates at various temperatures were obtained as the first derivatives. Several examples of applications are shown.

13C nuclear magnetic resonance studies of aromatic amine-borane adducts

Paz-Sandoval, M. A.,Camacho, C.,Contreras, R.,Wrackmeyer, B.

, p. 1331 - 1336 (2007/10/02)

13C NMR measurements are reported for 22 aromatic amine-borane, 7 aliphatic amine-borane, and 3 aliphatic amine-trimethylborane adducts.Additivity of the substituent effects on the δ 13C values of the aromatic carbon atoms is observed.The δ 13C values are compared with those of the arylamines of arylammonium salts and of corresponding alkyl-substituted benzenes.The δ 13C values for the borane adducts, ammonium salts and hydrocarbons exhibit the same trends.However, in the borane adducts similar to the ammonium salts, part of the shielding of the ortho-carbon atoms is attributed to electric field effects which are much less pronounced in the hydrocarbon analogues.The comparison of δ 13C values of aliphatic amine-borane adducts with those of corresponding hydrocarbons indicates the importance of steric effects.

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