Cas no 127168-70-1 (2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine)
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine Chemical and Physical Properties
Names and Identifiers
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- 2-Benzylisoindolin-5-amine
- 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine
- 2‐BENZYL‐2,3‐DIHYDRO‐1H‐ISOINDOL‐5‐YLAMINE
- 2-benzyl-1,3-dihydroisoindol-5-amine
- B90101
- TIMTEC-BB SBB011535
- [2-(benzyl)isoindolin-5-yl]amine
- 2-(phenylmethyl)isoindolin-5-amine
- 2-(phenylmethyl)-5-isoindolinamine
- 2-(phenylmethyl)-1,3-dihydroisoindol-5-amine
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- MDL: MFCD07186379
- Inchi: InChI=1S/C15H16N2/c16-15-7-6-13-10-17(11-14(13)8-15)9-12-4-2-1-3-5-12/h1-8H,9-11,16H2
- InChI Key: APHDKXQNTZQBHW-UHFFFAOYSA-N
- SMILES: C1=CC=C(C=C1)CN2CC3=CC=C(C=C3C2)N
Computed Properties
- Exact Mass: 224.13100
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
Experimental Properties
- PSA: 29.26000
- LogP: 3.30370
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine Security Information
- Hazard Category Code: 22
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Hazardous Material Identification:
- HazardClass:IRRITANT
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine Customs Data
- HS CODE:2933990090
- Customs Data:
China Customs Code:
2933990090Overview:
2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%
Declaration elements:
Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date
Summary:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | B011710-100mg |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine |
127168-70-1 | 100mg |
$ 185.00 | 2022-06-07 | ||
| TRC | B011710-250mg |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine |
127168-70-1 | 250mg |
$ 380.00 | 2022-06-07 | ||
| TRC | B011710-500mg |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine |
127168-70-1 | 500mg |
$ 600.00 | 2022-06-07 | ||
| Matrix Scientific | 019057-1g |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine |
127168-70-1 | 1g |
$400.00 | 2023-09-09 | ||
| Fluorochem | 038253-1g |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine |
127168-70-1 | 1g |
£409.00 | 2022-03-01 | ||
| Fluorochem | 038253-5g |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine |
127168-70-1 | 5g |
£1225.00 | 2022-03-01 | ||
| abcr | AB286808-500 mg |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine; 95% |
127168-70-1 | 500MG |
€313.80 | 2022-06-11 | ||
| abcr | AB286808-1 g |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine; 95% |
127168-70-1 | 1g |
€374.00 | 2022-06-11 | ||
| abcr | AB286808-5 g |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine; 95% |
127168-70-1 | 5g |
€978.00 | 2022-06-11 | ||
| Chemenu | CM229924-1g |
2-Benzylisoindolin-5-amine |
127168-70-1 | 95% | 1g |
$392 | 2024-08-02 |
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine Related Literature
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1. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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C. Achilli,G. F. Guidetti,A. Ciana,D. Capsoni,G. Minetti Biomater. Sci., 2016,4, 1417-1421
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Dongjia Han,Bing Xue,Juan Du,Tomohiro Miyatake,Hitoshi Tamiaki,Xin Xing,Wei Yuan,Yanyan Li Phys. Chem. Chem. Phys., 2016,18, 24252-24260
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Riccardo Spezia,Stefan Knecht,Benedetta Mennucci Phys. Chem. Chem. Phys., 2017,19, 17156-17166
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Kevin M. Koo,Abu Ali Ibn Sina,Laura G. Carrascosa,Muhammad J. A. Shiddiky Analyst, 2014,139, 6178-6184
Additional information on 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine
Comprehensive Overview of 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine (CAS No. 127168-70-1)
2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine (CAS No. 127168-70-1) is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research due to its unique structural properties. This compound, often referred to by its CAS number 127168-70-1, belongs to the isoindoline family, a class of heterocyclic compounds known for their versatility in drug discovery and material science. Researchers are particularly interested in its potential applications as a building block for central nervous system (CNS) therapeutics, given its structural similarity to bioactive molecules.
The growing demand for novel pharmaceutical intermediates has placed compounds like 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine in the spotlight. Recent trends in AI-driven drug discovery and high-throughput screening have further amplified its relevance, as scientists explore its interactions with neurotransmitter receptors. Questions such as "What are the synthetic routes for CAS 127168-70-1?" or "How does 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine compare to other CNS-targeting scaffolds?" are frequently searched in academic and industrial databases, reflecting its importance in modern medicinal chemistry.
From a synthetic perspective, 127168-70-1 is typically prepared through multi-step organic reactions involving reductive amination or cyclization strategies. Its benzyl-substituted isoindoline core offers steric and electronic features that are advantageous for modulating bioavailability and receptor binding affinity. These characteristics make it a valuable candidate for optimizing lead compounds in preclinical studies. Notably, its stability under physiological conditions has been a topic of discussion in forums focused on ADME (Absorption, Distribution, Metabolism, Excretion) properties.
In the context of green chemistry, researchers are also investigating eco-friendly synthesis methods for 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine, aligning with global sustainability goals. Searches like "CAS 127168-70-1 solvent-free synthesis" or "catalytic approaches for isoindoline derivatives" highlight this shift. Additionally, computational studies using molecular docking tools have predicted its potential interactions with G-protein-coupled receptors (GPCRs), a hot topic in precision medicine.
Quality control and analytical profiling of CAS No. 127168-70-1 rely heavily on techniques such as HPLC, NMR spectroscopy, and mass spectrometry. These methods ensure the compound's purity, which is critical for reproducible research outcomes. The compound's logP and pKa values, often queried in cheminformatics platforms, further underscore its pharmacokinetic relevance. As the pharmaceutical industry leans toward fragment-based drug design, 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine continues to serve as a promising molecular fragment.
In summary, 2-Benzyl-2,3-dihydro-1H-isoindol-5-ylamine (CAS No. 127168-70-1) represents a compelling case study at the intersection of organic synthesis, medicinal chemistry, and computational biology. Its adaptability to diverse research needs—from neuroscience to sustainable synthesis—positions it as a compound of enduring scientific interest. Future studies may explore its derivatives for tailored therapeutic applications, answering yet-unaddressed questions in the field.
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