68285-25-6

Basic information

• Product Name: (S)-1-(2-FLUOROPHENYL)ETHYLAMINE
• Synonyms: S-OF-PEM;(S)-1-(2-FLUOROPHENYL)ETHANAMINE;(S)-1-(2-FLUOROPHENYL)ETHYLAMINE;(S)-1-(2-Fluorophenyl)ethylamine, ee 98%;Benzenemethanamine, 2-fluoro-α-methyl-, (αS)-;(1S)-1-(2-Fluorophenyl)ethylamine;(S)-1-(2-FLUOROPHENYL)ETHYLAMINE-HCl;(S)-2-Fluoro-alpha-methylbenzylamine
• CAS NO: 68285-25-6
• Molecular Formula: C₈H₁₀FN
• Molecular Weight: 139.17
• Mol File: 68285-25-6.mol
• Article Data: 17

Chemical Properties

• Boiling Point: 62-63°C/6mm
• Flash Point: 70.2 °C
• Appearance: /
• Density: 1.063 g/cm³
• Vapor Pressure: 0.926mmHg at 25°C
• Refractive Index: 1.512
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: 8.62±0.10(Predicted)
• CAS DataBase Reference: (S)-1-(2-FLUOROPHENYL)ETHYLAMINE(CAS DataBase Reference)
• NIST Chemistry Reference: (S)-1-(2-FLUOROPHENYL)ETHYLAMINE(68285-25-6)
• EPA Substance Registry System: (S)-1-(2-FLUOROPHENYL)ETHYLAMINE(68285-25-6)

Safety Data

• Hazard Codes: Xi
• Statements: 52
• HazardClass: IRRITANT
• Hazardous Substances Data: 68285-25-6(Hazardous Substances Data)

Usage

General Description

(S)-1-(2-Fluorophenyl)ethylamine is a chemical compound with the molecular formula C8H10FN. It is an amine with a phenyl ring and a fluorine substituent, and it exists as a chiral molecule with its stereochemistry designated as (S). (S)-1-(2-FLUOROPHENYL)ETHYLAMINE is commonly used as a building block in the synthesis of various pharmaceuticals and other organic compounds. It can be synthesized through several chemical reactions, including the reduction of the corresponding nitro compound or the reductive amination of the corresponding ketone. (S)-1-(2-Fluorophenyl)ethylamine is considered to be a valuable intermediate in the field of organic chemistry due to its versatility and utility in the synthesis of diverse chemical compounds.

InChI:InChI=1/C8H10FN/c1-6(10)7-4-2-3-5-8(7)9/h2-6H,10H2,1H3/t6-/m0/s1

Upstream product

• 2836-82-0 (o-fluorophenyl)acetone 
• 445-27-2 2'-Fluoroacetophenone 
• 109-73-9 N-butylamine 
• 124-20-9 N-(3-aminopropyl)-1,4-diaminobutane 
• 462-94-2 1,5-diaminopentane 
• 445-26-1 1-(2-fluorophenyl)ethanol 
• 815-57-6 3-Methyl-2,4-pentanedione 
• 74788-44-6 1-(2-fluorophenyl)ethanamine 
• 87227-77-8 bishydrochloride salt of cis-1,4-diamino-but-2-ene 
• 1434602-30-8 1-(2-fluorophenyl)ethanone O-benzyloxime 
• 1434602-02-4 (E)-1-(2-fluorophenyl)ethan-1-one oxime 
• 1332832-14-0 (S)-1-(2-fluorophenyl)ethan-1-amine hydrochloride 
• 820208-98-8 C₈H₆O₄*C₁₆H₁₈FN 
• 130562-15-1 [1-(2-Fluoro-phenyl)-eth-(E)-ylidene]-((S)-1-phenyl-ethyl)-amine 

Downstream Products

• 1332832-14-0 (S)-1-(2-fluorophenyl)ethan-1-amine hydrochloride 
• 1332827-96-9 (S)-2,2,2-trifluoro-N-(1-(2-(fluoro)phenyl)ethyl)acetamide 
• 445-27-2 2'-Fluoroacetophenone 
• 1397715-11-5 3-{2-[(S)-1-(2-fluorophenyl)ethylamino]-6,6-dimethyl-4,4-dioxo-5,6-dihydro-4H-4lambda6-[1,4,3]-oxathiazin-5-yl}benzoic acid methyl ester 
• 1397712-50-3 [5-(3-bromophenyl)-6,6-dimethyl-4,4-dioxo-5,6-dihydro-4H-4lambda6-[1,4,3]-oxathiazin-2-yl]-[(S)-1-(2-fluorophenyl)ethyl]amine 
• 1397342-47-0 [(S)-1-(2-fluorophenyl)ethyl]-(5,5,6,6-tetramethyl-4,4-dioxo-5,6-dihydro-4H-4λ⁶-[1,4,3]oxathiazin-2-yl)amine 
• 1397712-66-1 [(S)-1-(2-fluorophenyl)-ethyl]-(5,6,6-trimethyl-4,4-dioxo-5-phenyl-5,6-dihydro-4H-4lambda6-[1,4,3]-oxathiazin-2-yl)amine 
• 1397712-53-6 [5-(3-bromophenyl)-5,6,6-trimethyl-4,4-dioxo-5,6-dihydro-4H-4lambda6-[1,4,3]-oxathiazin-2-yl]-[(S)-1-(2-fluorophenyl)ethyl]amine 
• 1453476-80-6 (S)-N-(1-(2-fluorophenyl)ethyl)-8-isopropyl-2-(methylsulfonyl)pyrazolo[1,5-a][1,3,5]triazin-4-amine 
• 1081979-69-2 C₁₁H₁₅FN₂OS 

Relevant articles and documents

Application of “Smart” Amine Donors for Rapid Screening and Scale-Up of Transaminase-Mediated Biotransformations

The “smart” amine donors o-xylylenediamine and cadaverine were employed for the rapid screening of a large ketone library and subsequent preparative-scale synthesis of selected compounds using a commercially available amine transaminase, ATA256. The methodology enables both screening and preparative-scale biotransformations to be performed with a single enzyme and simplifies the generation of sp3-rich small-molecule libraries.

Asymmetric catalysis of the carbonyl-amine condensation: Kinetic resolution of primary amines

A Br?nsted acid catalyzed kinetic resolution of primary amines is described that is based on the condensation between an amine and a carbonyl compound. 1,3-Diketones react with racemic α-branched amines to furnish the corresponding enantioenriched enaminone and recovered starting material. Good to excellent enantioselectivity was observed with both aromatic and aliphatic primary amines. This process represents the first small-molecule catalyzed kinetic resolution of aliphatic amines.

Stereoselective amination of racemic sec-alcohols through sequential application of laccases and transaminases

A one-pot/two-step bienzymatic asymmetric amination of secondary alcohols is disclosed. The approach is based on a sequential strategy involving the use of a laccase/TEMPO catalytic system for the oxidation of alcohols into ketone intermediates, and their following transformation into optically enriched amines by using transaminases. Individual optimizations of the oxidation and biotransamination reactions have been carried out, studying later their applicability in a concurrent process. Therefore, 17 racemic (hetero) aromatic sec-alcohols with different substitutions in the aromatic ring have been converted into enantioenriched amines with good to excellent selectivities (90-99% ee) and conversion values (67-99%). The scalability of the process was also demonstrated when two different amine donors were used in the transamination step, such as isopropylamine and cis-2-buten-1,4-diamine. Satisfyingly, both sacrificial amine donors can shift the equilibrium toward the amine formation, leading to the corresponding isolated enantioenriched amines with good to excellent results.