N-(4-Trifloromethybenzyl)cinchoninum bromide

N-(4-Trifloromethybenzyl)cinchoninum bromide - Names and Identifiers

Name	N-(4-Trifloromethybenzyl)cinchoninum bromide
Synonyms	N-(4-Trifloromethybenzyl)cinchoninum bromide N-(4-Trifloromethylbenzyl)cinchoninum Bromide N-(4-Trifluoromethybenzyl)cinchoninum bromide N-(4-TRIFLUOROMETHYLBENZYL)CINCHONINIUM BROMIDE
CAS	95088-20-3
InChI	InChI=1/C27H28F3N2O.BrH/c1-2-19-17-32(16-18-7-9-21(10-8-18)27(28,29)30)14-12-20(19)15-25(32)26(33)23-11-13-31-24-6-4-3-5-22(23)24;/h2-11,13,19-20,25-26,33H,1,12,14-17H2;1H/q+1;/p-1/t19?,20-,25+,26-,32+;/m0./s1
InChIKey	LOCWWLLFHKDFLF-KFGLDPKJSA-M

N-(4-Trifloromethybenzyl)cinchoninum bromide - Physico-chemical Properties

Molecular Formula	C27H28BrF3N2O
Molar Mass	533.43
Melting Point	245°C (dec.)(lit.)
BRN	9108995
Storage Condition	Room Temprature

N-(4-Trifloromethybenzyl)cinchoninum bromide - Risk and Safety

Hazard Symbols	Xi - Irritant
Risk Codes	36/37/38 - Irritating to eyes, respiratory system and skin.
Safety Description	S22 - Do not breathe dust. S24/25 - Avoid contact with skin and eyes. S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing.
WGK Germany	3
FLUKA BRAND F CODES	3

N-(4-Trifloromethybenzyl)cinchoninum bromide - Introduction

N-(4-Trifluoromethylbenzyl) cinchonine bromide is a compound with the formula C25H15BrF3N and a molecular weight of 491.29g/mol.

The following are the properties of this compound:

1. Appearance: White crystalline solid.
2. solubility: soluble in ethanol and chloroform, almost insoluble in water.
3. Melting point: about 145 ℃ to 148 ℃.

This compound is often used as a catalyst or ligand in organic synthesis reactions. Its main uses are as follows:

1. Asymmetric catalyst: It plays an important catalytic role in asymmetric synthesis and can be used in asymmetric organic synthesis reactions, such as asymmetric nucleophilic substitution reactions, asymmetric hydrogenation reactions, etc.
2. extended chiral pool: can be used to prepare chiral compounds, especially chiral pesticides and pharmaceutical intermediates.
3. Drug research: as one of the research substances of new drugs or ligands.

The preparation method is generally obtained by chemical synthesis. The specific preparation method is as follows:

1. 4-trifluoromethylbenzyl bromide reacts with cinchonine in an appropriate solvent to generate N-(4-trifluoromethylbenzyl) cinchonine bromide.
2. N-(4-trifluoromethylbenzyl) cinchonine bromide is reacted with an appropriate base to generate N-(4-trifluoromethylbenzyl) cinchonine bromide.

Regarding safety information, the following points should be noted:

1. This compound may be toxic, and appropriate protective measures should be worn during operation, such as safety glasses, protective gloves and protective clothing.
2. Keep away from fire and high temperature during use and storage to prevent it from burning or exploding.
3. Avoid inhaling aerosols or dust to avoid respiratory discomfort. If inhaled, should be quickly moved to a well-ventilated place, and consult a doctor.
4. avoid contact with skin and eyes, such as contact should immediately rinse with plenty of water, and consult a doctor.
5. Wastes shall be disposed according to regulations and shall not be dumped at will.

Last Update：2024-04-09 20:02:46