Cas no 96440-78-7 (3-tert-butyl-1H-1,2,4-triazole)
3-tert-butyl-1H-1,2,4-triazole Chemical and Physical Properties
Names and Identifiers
-
- 3-(tert-Butyl)-1H-1,2,4-triazole
- 3-tert-butyl-1H-1,2,4-triazole
- EN300-215054
- MFCD11847493
- 3-tert-Butyl-4H-1,2,4-triazole, AldrichCPR
- BB 0257966
- AT12318
- SCHEMBL3407374
- AKOS005174212
- FT-0683745
- SCHEMBL179500
- DTXSID20577885
- 3-t-butyl-1h-1,2,4-triazole
- 96440-78-7
- Z2130641278
- LS-04221
- 3-(TERT-BUTYL)-4H-1,2,4-TRIAZOLE
- H-1,2,4-Triazole,3-(1,1-Dimethylethyl)-
- 3-tert-butyl-4H-1,2,4-triazole
- 5-tert-butyl-1H-1,2,4-triazole
- OKQVUMMFRMUJMX-UHFFFAOYSA-N
- STL504691
- DB-090973
-
- MDL: MFCD11847493
- Inchi: 1S/C6H11N3/c1-6(2,3)5-7-4-8-9-5/h4H,1-3H3,(H,7,8,9)
- InChI Key: OKQVUMMFRMUJMX-UHFFFAOYSA-N
- SMILES: N1C(C(C)(C)C)=NC=N1
Computed Properties
- Exact Mass: 125.095297364g/mol
- Monoisotopic Mass: 125.095297364g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 95
- 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
- XLogP3: 1.7
- Topological Polar Surface Area: 41.6?2
3-tert-butyl-1H-1,2,4-triazole Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A449037887-1g |
3-(tert-Butyl)-1H-1,2,4-triazole |
96440-78-7 | 95% | 1g |
$528.00 | 2023-08-31 | |
| Chemenu | CM531110-1g |
3-(tert-Butyl)-1H-1,2,4-triazole |
96440-78-7 | 95% | 1g |
$*** | 2023-05-04 | |
| abcr | AB294624-250 mg |
3-tert-Butyl-4H-1,2,4-triazole; 95% |
96440-78-7 | 250mg |
€193.50 | 2023-04-26 | ||
| abcr | AB294624-1 g |
3-tert-Butyl-4H-1,2,4-triazole; 95% |
96440-78-7 | 1g |
€289.80 | 2023-04-26 | ||
| abcr | AB294624-5 g |
3-tert-Butyl-4H-1,2,4-triazole; 95% |
96440-78-7 | 5g |
€1012.20 | 2023-04-26 | ||
| TRC | T136028-50mg |
3-tert-butyl-1H-1,2,4-triazole |
96440-78-7 | 50mg |
$ 50.00 | 2022-06-03 | ||
| TRC | T136028-100mg |
3-tert-butyl-1H-1,2,4-triazole |
96440-78-7 | 100mg |
$ 70.00 | 2022-06-03 | ||
| TRC | T136028-500mg |
3-tert-butyl-1H-1,2,4-triazole |
96440-78-7 | 500mg |
$ 275.00 | 2022-06-03 | ||
| Enamine | EN300-215054-0.05g |
3-tert-butyl-1H-1,2,4-triazole |
96440-78-7 | 95% | 0.05g |
$65.0 | 2023-09-16 | |
| Enamine | EN300-215054-0.1g |
3-tert-butyl-1H-1,2,4-triazole |
96440-78-7 | 95% | 0.1g |
$98.0 | 2023-09-16 |
3-tert-butyl-1H-1,2,4-triazole Related Literature
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
Additional information on 3-tert-butyl-1H-1,2,4-triazole
3-tert-Butyl-1H-1,2,4-Triazole: Properties, Applications, and Market Insights
3-tert-Butyl-1H-1,2,4-triazole (CAS No. 96440-78-7) is a versatile heterocyclic compound that has garnered significant attention in both academic research and industrial applications. This triazole derivative is characterized by its unique molecular structure, which combines a tert-butyl group with a 1,2,4-triazole ring. Its chemical stability, reactivity, and functional versatility make it a valuable intermediate in organic synthesis, pharmaceuticals, and material science.
The growing interest in 3-tert-butyl-1H-1,2,4-triazole applications is driven by its role as a building block for more complex molecules. Researchers and industry professionals frequently search for "3-tert-butyl-1H-1,2,4-triazole synthesis" and "CAS 96440-78-7 uses" to explore its potential in drug development, agrochemicals, and advanced materials. Its compatibility with various reaction conditions further enhances its appeal in synthetic chemistry.
One of the most notable properties of 3-tert-butyl-1H-1,2,4-triazole is its ability to act as a ligand in coordination chemistry. This feature has led to its use in catalysis and metal-organic frameworks (MOFs), which are currently trending topics in materials science. Searches for "triazole-based ligands" and "MOF synthesis with 1,2,4-triazoles" highlight the compound's relevance in cutting-edge research.
In the pharmaceutical sector, 3-tert-butyl-1H-1,2,4-triazole serves as a key intermediate for the development of bioactive molecules. Its structural motif is found in compounds with antimicrobial, antifungal, and anti-inflammatory properties. The rising demand for novel therapeutics has increased queries about "3-tert-butyl-1H-1,2,4-triazole in drug discovery" and "CAS 96440-78-7 pharmacological applications."
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From a market perspective, the demand for 3-tert-butyl-1H-1,2,4-triazole is expected to grow steadily, driven by its diverse applications. Suppliers and manufacturers often search for "CAS 96440-78-7 suppliers" and "3-tert-butyl-1H-1,2,4-triazole price trends" to stay competitive. The compound's availability in high purity grades further supports its use in sensitive applications, such as electronic materials and specialty chemicals.
In conclusion, 3-tert-butyl-1H-1,2,4-triazole (CAS No. 96440-78-7) is a multifaceted compound with broad utility across multiple industries. Its chemical properties, coupled with emerging applications in pharmaceuticals, agriculture, and materials science, position it as a compound of significant interest. As research continues to uncover new uses, its market relevance is poised to expand, making it a key focus for scientists and industry stakeholders alike.
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