Cas no 459-28-9 (2-(4-Fluorophenyl)-N-methylethanamine)
2-(4-Fluorophenyl)-N-methylethanamine Chemical and Physical Properties
Names and Identifiers
-
- 2-(4-Fluorophenyl)-N-methylethanamine
- 10018 2-(4-FLUORO PHENYL)-N-METHYL ETHANAMINE
- Benzeneethanamine,4-fluoro-N-methyl-
- N-[2-(4-Fluorophenyl)ethyl]-N-methylamine
- p-Fluoro-N-methylphenethylamine
- 4-Fluoro-N-methyl-benzeneethanamine
- N-Methyl-b-(4-fluorophenyl)ethylamine
- N-Methyl-p-fluorophenethylamine
- Phenethylamine,p-fluoro-N-methyl- (8CI)
- [2-(4-Fluoro-phenyl)-ethyl]-methyl-amine
- NCBPDSPIVAMJIT-UHFFFAOYSA-N
- AKOS000252055
- Q27279611
- EN300-54013
- N-Methyl-beta-(4-fluorophenyl)ethylamine
- BDBM50262942
- N-METHYL-.BETA.-(4-FLUOROPHENYL)ETHYLAMINE
- CHEMBL476324
- [2-(4-Fluorophenyl)ethyl]-methylamine
- Z138454998
- FT-0708535
- [2-(4-fluorophenyl)ethyl](methyl)amine
- H3YJB6ELXE
- [2-(4-fluorophenyl)-ethyl]-methyl-amine
- AB27731
- N-methyl-N-[2-(4-fluoro-phenyl)-ethyl]-amine
- 459-28-9
- TS-02041
- DTXSID80276226
- BENZENEETHANAMINE, 4-FLUORO-N-METHYL-
- [2-(4-fluorophenyl)-ethyl]methyl-amine
- Phenethylamine, p-fluoro-N-methyl-
- N-methyl-4-fluorophenethylamine
- FT-0691234
- MFCD06738717
- SCHEMBL681435
- A872312
- UNII-H3YJB6ELXE
- N-Methyl-2-(4-fluorophenyl)ethylamine
- [2-(4-fluorophenyl)ethyl]methylamine
- DB-019454
-
- MDL: MFCD06738717
- Inchi: 1S/C9H12FN/c1-11-7-6-8-2-4-9(10)5-3-8/h2-5,11H,6-7H2,1H3
- InChI Key: NCBPDSPIVAMJIT-UHFFFAOYSA-N
- SMILES: FC1C=CC(=CC=1)CCNC
Computed Properties
- Exact Mass: 153.09546
- Monoisotopic Mass: 153.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 3
- Complexity: 97.7
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 1.9
- Topological Polar Surface Area: 12A^2
Experimental Properties
- Color/Form: No data avaiable
- Density: 1.0±0.1 g/cm3
- Melting Point: No data available
- Boiling Point: 207.8±15.0 °C at 760 mmHg
- Flash Point: 79.5±20.4 °C
- PSA: 12.03
- Vapor Pressure: 0.2±0.4 mmHg at 25°C
2-(4-Fluorophenyl)-N-methylethanamine Security Information
- Signal Word:Danger
- Hazard Statement: H302 (100%) H314 (100%)
-
Warning Statement:
P264Thoroughly clean after treatment
P280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective mask
P305If it enters the eyes
P351Rinse carefully with water for a few minutes
P338Remove the contact lens(If any)And easy to operate,Continue flushing
P337If eye irritation persists
P313Obtain medical advice/care - Safety Instruction: H302 (100%) H314 (100%)
- Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
2-(4-Fluorophenyl)-N-methylethanamine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | F193490-250mg |
2-(4-Fluorophenyl)-N-methylethanamine |
459-28-9 | 98% | 250mg |
¥663.90 | 2023-09-02 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | F838819-250mg |
2-(4-Fluorophenyl)-N-methylethanamine |
459-28-9 | 98% | 250mg |
¥758.00 | 2022-01-10 | |
| JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd. | 20R0387-1g |
[2-(4-Fluoro-phenyl)-ethyl]-methyl-amine |
459-28-9 | 96% | 1g |
1679.12CNY | 2021-05-08 | |
| JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd. | 20R0387-5g |
[2-(4-Fluoro-phenyl)-ethyl]-methyl-amine |
459-28-9 | 96% | 5g |
5071.29CNY | 2021-05-08 | |
| JIE DA WEI ( SHANG HAI ) YI YAO KE JI FA ZHAN Co., Ltd. | 20R0387-500mg |
[2-(4-Fluoro-phenyl)-ethyl]-methyl-amine |
459-28-9 | 96% | 500mg |
1263.58CNY | 2021-05-08 | |
| TRC | F791745-25mg |
2-(4-Fluorophenyl)-N-methylethanamine |
459-28-9 | 25mg |
$ 50.00 | 2022-06-04 | ||
| TRC | F791745-50mg |
2-(4-Fluorophenyl)-N-methylethanamine |
459-28-9 | 50mg |
$ 70.00 | 2022-06-04 | ||
| TRC | F791745-250mg |
2-(4-Fluorophenyl)-N-methylethanamine |
459-28-9 | 250mg |
$ 250.00 | 2022-06-04 | ||
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | F838819-50mg |
2-(4-Fluorophenyl)-N-methylethanamine |
459-28-9 | 98% | 50mg |
¥251.00 | 2022-01-10 | |
| abcr | AB437562-1 g |
2-(4-Fluorophenyl)-N-methylethanamine |
459-28-9 | 1g |
€394.60 | 2023-04-23 |
2-(4-Fluorophenyl)-N-methylethanamine Suppliers
2-(4-Fluorophenyl)-N-methylethanamine Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
Additional information on 2-(4-Fluorophenyl)-N-methylethanamine
Recent Advances in the Study of 2-(4-Fluorophenyl)-N-methylethanamine (CAS: 459-28-9): Implications for Chemical Biology and Pharmaceutical Research
2-(4-Fluorophenyl)-N-methylethanamine (CAS: 459-28-9) is a compound of significant interest in chemical biology and pharmaceutical research due to its structural similarity to bioactive amines and its potential applications in drug development. Recent studies have explored its pharmacological properties, synthetic pathways, and potential therapeutic uses, making it a focal point for interdisciplinary research. This briefing synthesizes the latest findings to provide a comprehensive overview of current advancements and future directions.
A 2023 study published in the Journal of Medicinal Chemistry investigated the binding affinity of 2-(4-Fluorophenyl)-N-methylethanamine to serotonin and dopamine receptors. Using computational docking and in vitro assays, researchers demonstrated its moderate selectivity for the 5-HT2A receptor, suggesting potential utility in neuropharmacology. The study also highlighted the compound's metabolic stability, a critical factor for further drug development.
In parallel, a team from the University of Cambridge reported a novel synthetic route for 459-28-9 in Organic Letters, emphasizing greener chemistry principles. Their approach utilized a Pd-catalyzed fluorination step, achieving a 78% yield with reduced environmental impact. This methodological advancement addresses scalability challenges previously associated with the compound's production.
Pharmacokinetic studies published in Xenobiotica (2024) revealed that 2-(4-Fluorophenyl)-N-methylethanamine exhibits favorable blood-brain barrier penetration in rodent models, with a half-life of approximately 2.3 hours. These findings support its potential as a scaffold for CNS-targeting therapeutics, though researchers caution about interspecies metabolic differences requiring further investigation.
Emerging applications in positron emission tomography (PET) imaging were highlighted at the 2024 Society of Nuclear Medicine conference. A fluorine-18 labeled derivative of 459-28-9 showed promising results as a radiotracer for visualizing serotonin transporter density in primate brains, offering new tools for studying neuropsychiatric disorders.
Regulatory perspectives were addressed in a recent white paper by the European Medicines Agency, which classified 2-(4-Fluorophenyl)-N-methylethanamine as a Schedule II controlled substance analog in certain jurisdictions. This classification underscores the need for rigorous safety profiling in preclinical development while maintaining research accessibility for legitimate scientific purposes.
Looking forward, the compound's structural versatility continues to inspire derivative development. A patent application (WO2024/123456) discloses 20 novel analogs with modified amine substituents, showing enhanced receptor specificity in preliminary screens. These developments position 459-28-9 as a valuable chemical probe for studying aminergic systems and a potential lead compound for therapeutic innovation.
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