52721-69-4

Basic information

• Product Name: 2-FLUOROPHENETHYLAMINE
• Synonyms: 2-FLUOROPHENETHYLAMINE;RARECHEM AL BW 0202;2-FLUOROPHETHYLAMINE 99%;2-Fluorophenethylamine ,98%;2-Fluorophenethylamine,99%;FluorophenethylaMiner;2-FluorobenzeneethanaMine;BenzeneethanaMine,2-fluoro-
• CAS NO: 52721-69-4
• Molecular Formula: C₈H₁₀FN
• Molecular Weight: 139.17
• Product Categories: Amines and Anilines;Amines;C8;Nitrogen Compounds;Fluorine series
• Mol File: 52721-69-4.mol
• Article Data: 8

Chemical Properties

• Boiling Point: 64 °C0.6 mm Hg(lit.)
• Flash Point: 171 °F
• Appearance: Clear yellow to dark yellow to orange/Liquid
• Density: 1.066 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.0333mmHg at 25°C
• Refractive Index: n20/D 1.51(lit.)
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• PKA: 9.47±0.10(Predicted)
• CAS DataBase Reference: 2-FLUOROPHENETHYLAMINE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-FLUOROPHENETHYLAMINE(52721-69-4)
• EPA Substance Registry System: 2-FLUOROPHENETHYLAMINE(52721-69-4)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39
• RIDADR: UN 2735 8/PG 2
• WGK Germany: 3
• HazardClass: 8
• PackingGroup: II
• Hazardous Substances Data: 52721-69-4(Hazardous Substances Data)

Usage

Description

2-Fluorophenethylamine, also known as 2-Fluorophenethylamine, is an amine derived from phenethylamine with a fluorine atom substitution at the 2nd position. It is a clear pale yellow to slightly pink liquid and is known for its unique chemical properties.

Uses

Used in Chemical Synthesis:
2-Fluorophenethylamine is used as a chemical intermediate for the synthesis of various compounds, such as ethyl 2-cyano-3-(N-2-fluorophenethylamino)-3-methythioacrylate. It plays a crucial role in the development of new chemical entities with potential applications in various industries.
Used in Derivatization:
In the field of organic chemistry, 2-Fluorophenethylamine is used for the derivatization of methoxybenzaldehyde polystyrene resin. This process allows for the functionalization and modification of the resin, which can be utilized in various applications, such as catalysis, drug discovery, and material science.
Used in Pharmaceutical Industry:
2-Fluorophenethylamine may also find applications in the pharmaceutical industry, where it can be used as a building block for the development of new drugs with improved pharmacological properties. Its unique structure and reactivity make it a valuable component in the design and synthesis of novel therapeutic agents.
Used in Material Science:
In the field of material science, 2-Fluorophenethylamine can be employed in the development of new materials with specific properties, such as improved stability, reactivity, or selectivity. Its incorporation into polymers, resins, or other materials can lead to the creation of advanced materials with potential applications in various industries, including electronics, coatings, and adhesives.

InChI:InChI=1/C8H10FN/c9-8-4-2-1-3-7(8)5-6-10/h1-4H,5-6,10H2/p+1

Upstream product

• 50919-06-7 2-(2-fluorophenyl)ethanol 
• 451-69-4 2-fluorocinnamic acid 
• 2629-55-2 2-fluoro-DL-phenylalanine 
• 75321-85-6 2-(2-fluorophenyl)acetaldehyde 
• 74249-17-5 (S)-2-(2-fluorophenyl)oxirane 
• 394-46-7 2-fluorostyrene 
• 446-52-6 2-Fluorobenzaldehyde 
• 399-25-7 1-fluoro-2-(2-nitro-vinyl)-benzene 

Downstream Products

• 101565-60-0 N⁶-<2-(fluorophenyl)ethyl>adenosine 
• 291313-93-4 N,N-bis(benzotriazol-1-ylmethyl)-2-fluoro-β-phenylethylamine 
• 610312-12-4 [1-((3aR,5R,6S,6aR)-6-Benzyloxy-2,2-dimethyl-tetrahydro-furo[2,3-d][1,3]dioxol-5-yl)-meth-(E)-ylidene]-[2-(2-fluoro-phenyl)-ethyl]-amine 
• 347161-81-3 2,7-di-tert-butyl-5-[(2-fluorophenyl)ethylcarbamoyl]-9,9-dimethyl-9H-xanthene-4-carboxylic acid phenyl ester 

Relevant articles and documents

Bi-enzymatic Conversion of Cinnamic Acids to 2-Arylethylamines

The conversion of carboxylic acids, such as acrylic acids, to amines is a transformation that remains challenging in synthetic organic chemistry. Despite the ubiquity of similar moieties in natural metabolic pathways, biocatalytic routes seem to have been overlooked for this purpose. Herein we present the conception and optimisation of a two-enzyme system, allowing the synthesis of β-phenylethylamine derivatives from readily-available ring-substituted cinnamic acids. After characterisation of both parts of the reaction in a two-step approach, a set of conditions allowing the one-pot biotransformation was optimised. This combination of a reversible deaminating and irreversible decarboxylating enzyme, both specific for the amino acid intermediate in tandem, represents a general method by which new strategies for the conversion of carboxylic acids to amines could be designed.

Biocatalytic Formal Anti-Markovnikov Hydroamination and Hydration of Aryl Alkenes

Biocatalytic anti-Markovnikov alkene hydroamination and hydration were achieved based on two concepts involving enzyme cascades: epoxidation-isomerization-amination for hydroamination and epoxidation-isomerization-reduction for hydration. An Escherichia coli strain coexpressing styrene monooxygenase (SMO), styrene oxide isomerase (SOI), ω-transaminase (CvTA), and alanine dehydrogenase (AlaDH) catalyzed the hydroamination of 12 aryl alkenes to give the corresponding valuable terminal amines in high conversion (many ≥86%) and exclusive anti-Markovnikov selectivity (>99:1). Another E. coli strain coexpressing SMO, SOI, and phenylacetaldehyde reductase (PAR) catalyzed the hydration of 12 aryl alkenes to the corresponding useful terminal alcohols in high conversion (many ≥80%) and very high anti-Markovnikov selectivity (>99:1). Importantly, SOI was discovered for stereoselective isomerization of a chiral epoxide to a chiral aldehyde, providing some insights on enzymatic epoxide rearrangement. Harnessing this stereoselective rearrangement, highly enantioselective anti-Markovnikov hydroamination and hydration were demonstrated to convert α-methylstyrene to the corresponding (S)-amine and (S)-alcohol in 84-81% conversion with 97-92% ee, respectively. The biocatalytic anti-Markovnikov hydroamination and hydration of alkenes, utilizing cheap and nontoxic chemicals (O2, NH3, and glucose) and cells, provide an environmentally friendly, highly selective, and high-yielding synthesis of terminal amines and alcohols.

2-aminobenzoxazole derivatives and combinatorial libraries thereof

The present invention relates to novel 2-aminobenzoxazole derivative compounds of the following formula: wherein R1 to R4 and Z have the meanings provided herein. The invention further relates to combinatorial libraries containing two or more such compounds, as well as methods of preparing 2-aminobenzoxazole derivative compounds.