Cas no 212968-67-7 ((1S)-1-(4-ethylphenyl)ethan-1-amine)
(1S)-1-(4-ethylphenyl)ethan-1-amine Chemical and Physical Properties
Names and Identifiers
-
- (S)-1-(4-Ethylphenyl)ethanamine
- (S)-1-(4-ETHYLPHENYL)ETHANAMINE-HCL
- Benzenemethanamine, 4-ethyl-a-methyl-, (aS)-
- BS-49044
- Benzenemethanamine, 4-ethyl--methyl-, (S)-
- Y13670
- SCHEMBL12808597
- (1S)-1-(4-ethylphenyl)ethylamine
- (1S)-1-(4-ethylphenyl)ethanamine
- (S)-4-Ethyl-alpha-methylbenzylamine
- 212968-67-7
- AKOS015842815
- (S)-1-(4-ETHYLPHENYL)ETHAN-1-AMINE
- EN300-87823
- (1S)-1-(4-ethylphenyl)ethan-1-amine
- CS-0000325
-
- MDL: MFCD06761884
- Inchi: 1S/C10H15N/c1-3-9-4-6-10(7-5-9)8(2)11/h4-8H,3,11H2,1-2H3/t8-/m0/s1
- InChI Key: AMXXYSXDJUIPMZ-QMMMGPOBSA-N
- SMILES: N[C@@H](C)C1C=CC(=CC=1)CC
Computed Properties
- Exact Mass: 149.12055
- Monoisotopic Mass: 149.120449483g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 103
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2
- Topological Polar Surface Area: 26?2
Experimental Properties
- PSA: 26.02
(1S)-1-(4-ethylphenyl)ethan-1-amine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM191933-1g |
(S)-1-(4-Ethylphenyl)ethanamine |
212968-67-7 | 95% | 1g |
$640 | 2021-06-16 | |
| Alichem | A019116175-1g |
(S)-1-(4-Ethylphenyl)ethanamine |
212968-67-7 | 95% | 1g |
$563.04 | 2023-09-02 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | S32860-100mg |
(S)-1-(4-Ethylphenyl)ethanamine |
212968-67-7 | 95% | 100mg |
¥565.0 | 2024-07-19 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | S32860-1g |
(S)-1-(4-Ethylphenyl)ethanamine |
212968-67-7 | 95% | 1g |
¥2586.0 | 2024-07-19 | |
| SHANG HAI JI ZHI SHENG HUA Technology Co., Ltd. | S32860-250mg |
(S)-1-(4-Ethylphenyl)ethanamine |
212968-67-7 | 95% | 250mg |
¥959.0 | 2024-07-19 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-LD244-200mg |
(1S)-1-(4-ethylphenyl)ethan-1-amine |
212968-67-7 | 95+% | 200mg |
1391.0CNY | 2021-07-14 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-LD244-50mg |
(1S)-1-(4-ethylphenyl)ethan-1-amine |
212968-67-7 | 95+% | 50mg |
557.0CNY | 2021-07-14 | |
| Chemenu | CM191933-1g |
(S)-1-(4-Ethylphenyl)ethanamine |
212968-67-7 | 95% | 1g |
$640 | 2022-06-12 | |
| Enamine | EN300-87823-0.05g |
(1S)-1-(4-ethylphenyl)ethan-1-amine |
212968-67-7 | 0.05g |
$167.0 | 2023-09-01 | ||
| Enamine | EN300-87823-0.1g |
(1S)-1-(4-ethylphenyl)ethan-1-amine |
212968-67-7 | 0.1g |
$174.0 | 2023-09-01 |
(1S)-1-(4-ethylphenyl)ethan-1-amine Suppliers
(1S)-1-(4-ethylphenyl)ethan-1-amine Related Literature
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
Additional information on (1S)-1-(4-ethylphenyl)ethan-1-amine
Research Brief on (1S)-1-(4-ethylphenyl)ethan-1-amine (CAS: 212968-67-7): Recent Advances and Applications
The compound (1S)-1-(4-ethylphenyl)ethan-1-amine (CAS: 212968-67-7) has garnered significant attention in the field of chemical biology and pharmaceutical research due to its potential applications in drug development and therapeutic interventions. This research brief synthesizes the latest findings on this chiral amine, focusing on its synthesis, biological activity, and emerging roles in medicinal chemistry. Recent studies highlight its utility as a key intermediate in the synthesis of bioactive molecules, particularly in the development of central nervous system (CNS) targeting agents.
Recent advancements in asymmetric synthesis have enabled more efficient production of (1S)-1-(4-ethylphenyl)ethan-1-amine with high enantiomeric purity. A 2023 study published in the Journal of Medicinal Chemistry demonstrated a novel enzymatic resolution method achieving >99% ee, significantly improving upon previous synthetic routes. This breakthrough has important implications for scaling up production while maintaining the stereochemical integrity critical for pharmacological activity. The study also revealed that the (S)-enantiomer exhibits 3-5 fold greater receptor binding affinity compared to its (R)-counterpart in serotonin receptor assays.
Pharmacological investigations have identified (1S)-1-(4-ethylphenyl)ethan-1-amine as a promising scaffold for developing novel antidepressants and anxiolytics. In vitro studies using human monoamine transporters show selective inhibition of serotonin reuptake (SERT IC50 = 12.3 nM) with minimal effects on dopamine and norepinephrine transporters. This selectivity profile, combined with molecular modeling data published in ACS Chemical Neuroscience (2024), suggests the compound's potential for developing next-generation SSRIs with reduced side effects. Notably, the ethylphenyl moiety appears to confer improved blood-brain barrier penetration compared to simpler phenyl derivatives.
Emerging applications extend beyond CNS disorders, with recent patent filings (WO2023184567) disclosing derivatives of 212968-67-7 as potent inhibitors of lysine-specific demethylase 1 (LSD1) for cancer therapy. The chiral center proves crucial for target engagement, as demonstrated by crystallographic studies showing hydrogen bonding between the amine group and FAD cofactor in LSD1. These findings position (1S)-1-(4-ethylphenyl)ethan-1-amine as a versatile building block for both neurological and oncological drug discovery programs.
Ongoing clinical investigations (Phase I/II trials NCT05678922) are evaluating the safety and pharmacokinetics of a pro-drug formulation containing this amine moiety. Preliminary results indicate favorable oral bioavailability (F = 78%) and linear pharmacokinetics up to 300 mg doses. The compound's metabolic stability, attributed to the ethyl substitution pattern, addresses common limitations of similar aromatic amines, as detailed in a recent review in Drug Metabolism Reviews (2024). These properties make it particularly attractive for chronic administration regimens.
In conclusion, (1S)-1-(4-ethylphenyl)ethan-1-amine represents a chemically and biologically significant compound with expanding therapeutic potential. The convergence of improved synthetic methods, detailed mechanistic understanding, and promising clinical data suggests this chiral amine will continue to play an important role in pharmaceutical development. Future research directions likely include exploration of additional derivatives and combination therapies leveraging its unique pharmacophoric features.
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