Cas no 317830-77-6 (1H-Indole-1-carboxylicacid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester)
1H-Indole-1-carboxylicacid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 1H-Indole-1-carboxylicacid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester
- 3-(1-AMINO-ETHYL)-INDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
- tert-butyl 3-(1-aminoethyl)indole-1-carboxylate
- 1-(N-tert-Butoxycarbonylindol-3-yl)ethylamine
- A820992
- AB27919
- AG-F-06062
- AGN-PC-01V6RY
- CTK4G7722
- SureCN7024562
- SCHEMBL7024562
- DTXSID10593256
- TERT-BUTYL3-(1-AMINOETHYL)-1H-INDOLE-1-CARBOXYLATE
- 1H-Indole-1-carboxylicacid,3-(1-aminoethyl)-,1,1-dimethylethyl ester
- TERT-BUTYL 3-(1-AMINOETHYL)-1H-INDOLE-1-CARBOXYLATE
- tert-Butyl 3-(1-aminoethyl)-1H-indole-1-carboxylate, 97%
- 317830-77-6
- FT-0743337
- DB-068523
-
- Inchi: 1S/C15H20N2O2/c1-10(16)12-9-17(14(18)19-15(2,3)4)13-8-6-5-7-11(12)13/h5-10H,16H2,1-4H3
- InChI Key: XEQUWHVSDLOFGR-UHFFFAOYSA-N
- SMILES: O(C(N1C=C(C(C)N)C2C=CC=CC1=2)=O)C(C)(C)C
Computed Properties
- Exact Mass: 260.15200
- Monoisotopic Mass: 260.152
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 338
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 57.2A^2
- XLogP3: 2.5
Experimental Properties
- PSA: 57.25000
- LogP: 4.14450
1H-Indole-1-carboxylicacid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM258839-1g |
tert-Butyl 3-(1-aminoethyl)-1H-indole-1-carboxylate |
317830-77-6 | 95%+ | 1g |
$813 | 2021-08-18 | |
| Alichem | A199009423-1g |
tert-Butyl 3-(1-aminoethyl)-1H-indole-1-carboxylate |
317830-77-6 | 97% | 1g |
$896.10 | 2023-09-02 | |
| Chemenu | CM258839-1g |
tert-Butyl 3-(1-aminoethyl)-1H-indole-1-carboxylate |
317830-77-6 | 95%+ | 1g |
$838 | 2023-02-02 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1733122-1g |
tert-Butyl 3-(1-aminoethyl)-1h-indole-1-carboxylate |
317830-77-6 | 98% | 1g |
¥8883.00 | 2024-08-02 | |
| Ambeed | A675619-1g |
tert-Butyl 3-(1-aminoethyl)-1H-indole-1-carboxylate |
317830-77-6 | 97% | 1g |
$846.0 | 2024-04-20 |
1H-Indole-1-carboxylicacid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
Additional information on 1H-Indole-1-carboxylicacid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester
Comprehensive Guide to 1H-Indole-1-carboxylic acid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester (CAS No. 317830-77-6)
1H-Indole-1-carboxylic acid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester (CAS No. 317830-77-6) is a specialized organic compound that has garnered significant attention in pharmaceutical and biochemical research. This indole derivative is characterized by its unique molecular structure, which includes an aminoethyl group at the 3-position and a tert-butyl ester moiety. The compound's versatility makes it a valuable intermediate in the synthesis of more complex molecules, particularly in drug discovery and development.
The growing interest in indole derivatives like 1H-Indole-1-carboxylic acid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester stems from their broad biological activities. Researchers are increasingly exploring these compounds for their potential in treating neurological disorders, inflammation, and even certain types of cancer. The aminoethyl side chain, in particular, enhances the molecule's ability to interact with biological targets, making it a promising candidate for further study.
One of the most frequently asked questions about CAS No. 317830-77-6 is its solubility and stability under various conditions. This compound is typically soluble in organic solvents such as dimethyl sulfoxide (DMSO) and methanol, but exhibits limited solubility in water. Its stability is influenced by factors like pH, temperature, and exposure to light, which are critical considerations for storage and handling in laboratory settings.
In recent years, the demand for 1H-Indole-1-carboxylic acid derivatives has surged, driven by advancements in medicinal chemistry. The tert-butyl ester group in this compound serves as a protective group, allowing for selective modifications during synthetic processes. This feature is particularly valuable in multi-step synthesis, where precise control over reactivity is essential.
Another hot topic in the scientific community is the role of indole-based compounds in modulating enzyme activity. 1H-Indole-1-carboxylic acid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester has shown potential as a scaffold for designing enzyme inhibitors, which are crucial in developing targeted therapies. Researchers are actively investigating its interactions with specific enzymes to unlock new therapeutic avenues.
The synthesis of CAS No. 317830-77-6 often involves multi-step reactions, starting from readily available indole precursors. Key steps include the introduction of the aminoethyl group and the subsequent esterification with tert-butanol. Optimizing these reactions for higher yields and purity remains a focus for chemists, as the compound's quality directly impacts its applicability in downstream research.
From a commercial perspective, 1H-Indole-1-carboxylic acid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester is supplied by several specialty chemical manufacturers. Pricing and availability can vary based on scale and purity requirements, with higher-purity grades commanding a premium. Researchers are advised to verify the specifications and certificates of analysis when sourcing this compound for critical applications.
Looking ahead, the future of indole derivatives like CAS No. 317830-77-6 appears bright, with ongoing studies exploring their potential in drug delivery systems and bioimaging. The compound's unique structural features make it a versatile tool for innovation, and its applications are expected to expand as research progresses.
In summary, 1H-Indole-1-carboxylic acid, 3-(1-aminoethyl)-, 1,1-dimethylethyl ester (CAS No. 317830-77-6) is a compound of significant scientific and commercial interest. Its role in pharmaceutical research, coupled with its structural versatility, ensures its continued relevance in the ever-evolving field of medicinal chemistry.
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