2,2,2-Trifluoroethylazanium;chloride

Base Information

• Chemical Name: 2,2,2-Trifluoroethylazanium;chloride
• CAS No.: 373-88-6
• Molecular Formula: C2H4F3N.HCl
• Molecular Weight: 135.517
• Hs Code.: 29211990
• Mol file: 373-88-6.mol

Synonyms:2,2,2-trifluoroethylazanium;chloride;AKOS017345167;2,2,2-Trifluoro-ethyl-ammonium

Chemical Property of 2,2,2-Trifluoroethylazanium;chloride

Chemical Property:

• Appearance/Colour: white to light yellow crystalline powder
• Vapor Pressure: 501mmHg at 25°C
• Melting Point: 220-222 °C (subl.)(lit.)
• Refractive Index: 1,3-1,302
• Boiling Point: 36 °C at 760 mmHg
• Flash Point: 27.6oC
• PSA: 26.02000
• Density: 1.24 g/cm³
• LogP: 2.00970
• Storage Temp.: Inert atmosphere,Room Temperature
• Sensitive.: Hygroscopic
• Water Solubility.: It is Soluble in 0.7 to water, but soluble in ethanol and chloroform, slightly soluble in benzene, hardly soluble in ether.
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 135.0062613
• Heavy Atom Count: 7
• Complexity: 38.5

Purity/Quality:

98%, ^*data from raw suppliers

TAF ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn, T, Xi
• Hazard Codes: Xn,T,Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 36/37-24/25-36-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(C(F)(F)F)[NH3+].[Cl-]
• Uses: 2,2,2-Trifluoroethylamine Hydrochloride is a reagent in the synthesis of arachidonylethanolamide analogs. These show affinity for CB1 and CB2 cannabinoid receptors.

Technology Process of 2,2,2-Trifluoroethylazanium;chloride

There total 5 articles about 2,2,2-Trifluoroethylazanium;chloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.3%

trifluoroethylamine (753-90-2) → 2,2,2-trifluroethylamine hydrochloride (373-88-6)

Guidance literature:

With hydrogenchloride; In ethanol; water; at 25 - 50 ℃; for 1h; Temperature;

Reference yield: 94.0%

benzylamine (100-46-9) + trifluoroacetic acid (76-05-1) → 2,2,2-trifluroethylamine hydrochloride (373-88-6)

Guidance literature:

benzylamine; trifluoroacetic acid; With tetrachloromethane; TEA; triphenylphosphine; In chloroform; at 80 ℃; for 0.666667h;

With TEA; water; at 80 ℃; for 12h;

With hydrogenchloride; In methanol; for 12h; Heating;

DOI:10.1016/S0040-4039(02)01104-8

Reference yield: 87.0%

[1-Phenyl-meth-(E)-ylidene]-(2,2,2-trifluoro-ethyl)-amine → 2,2,2-trifluroethylamine hydrochloride (373-88-6)

Guidance literature:

With hydrogenchloride; In diethyl ether; for 4h; Ambient temperature;

DOI:10.1016/S0040-4039(00)76845-6

upstream raw materials:

N-(2,2,2-trifluoroethyl)benzamide

benzylamine

trifluoroacetic acid

trifluoroethylamine

Downstream raw materials:

N-[(phenyl)(pyrrolidin-1-yl)methylene]-N'-(2,2,2-trifluoroethyl)benzamidine

C₁₆H₂₀F₃NO₅

(+/-)-1-methoxy-4-((trans)-2-(trifluoromethyl)cyclopropyl)benzene

Refernces

• 1、 Soloshonok, Vadim A,Ohkura, Hironari,Uneyama, Kenji. "Biomimetic reductive amination of perfluoroalkylcarboxylic acids to α,α-dihydroperfluoroalkylamines". . p. 5449 - 5452. Retrieved 2007/10/03.
• 2、 Larson,McMahon. "HYDROGEN BONDING IN GAS-PHASE ANIONS. AN EXPERIMENTAL INVESTIGATION OF THE INTERACTION BETWEEN CHLORIDE ION AND BRONSTED ACIDS FROM ION CYCLOTRON RESONANCE CHLORIDE EXCHANGE EQUILIBRIA.". . p. 517 - 521. Retrieved 2007/10/02.