Cas no 885273-60-9 (3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde)
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde Chemical and Physical Properties
Names and Identifiers
-
- 5-Isoxazolecarboxaldehyde,3-(3,5-dimethylphenyl)-
- 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde
- 3-(3,5-Dimethyl-phenyl)-isoxazole-5-carbaldehyde
- 3-(3,5-DIMETHYLPHENYL)ISOXAZOLE-5-CARBALDEHYDE,
- 5-Isoxazolecarboxaldehyde,3-(3,5-dimethylphenyl)
- 3-(3,5-Dimethylphenyl)isoxazole-5-carbaldehyde
- 885273-60-9
- AB27283
- FT-0723912
- A862055
- DTXSID60695996
-
- Inchi: 1S/C12H11NO2/c1-8-3-9(2)5-10(4-8)12-6-11(7-14)15-13-12/h3-7H,1-2H3
- InChI Key: ZQHKAZXLWXNANG-UHFFFAOYSA-N
- SMILES: O1C(C=O)=CC(C2C=C(C)C=C(C)C=2)=N1
Computed Properties
- Exact Mass: 201.07900
- Monoisotopic Mass: 201.079
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 222
- 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: 2.6
- Topological Polar Surface Area: 43.1A^2
Experimental Properties
- PSA: 43.10000
- LogP: 2.77090
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde Customs Data
- HS CODE:2934999090
- Customs Data:
China Customs Code:
2934999090Overview:
2934999090. Other heterocyclic compounds. 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
Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Chemenu | CM190740-1g |
3-(3,5-Dimethyl-phenyl)-isoxazole-5-carbaldehyde |
885273-60-9 | 95% | 1g |
$*** | 2023-05-29 | |
| Chemenu | CM190740-1g |
3-(3,5-Dimethyl-phenyl)-isoxazole-5-carbaldehyde |
885273-60-9 | 95% | 1g |
$754 | 2021-08-05 | |
| Enamine | EN300-380615-1.0g |
3-(3,5-DIMETHYL-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE |
885273-60-9 | 1.0g |
$903.0 | 2023-03-02 | ||
| Enamine | EN300-380615-2.5g |
3-(3,5-DIMETHYL-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE |
885273-60-9 | 2.5g |
$1871.0 | 2023-03-02 | ||
| Enamine | EN300-380615-5.0g |
3-(3,5-DIMETHYL-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE |
885273-60-9 | 5.0g |
$2369.0 | 2023-03-02 | ||
| Enamine | EN300-380615-10.0g |
3-(3,5-DIMETHYL-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE |
885273-60-9 | 10.0g |
$2980.0 | 2023-03-02 | ||
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBTQ4968-100MG |
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde |
885273-60-9 | 95% | 100MG |
¥ 976.00 | 2023-04-13 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBTQ4968-250MG |
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde |
885273-60-9 | 95% | 250MG |
¥ 1,564.00 | 2023-04-13 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBTQ4968-500MG |
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde |
885273-60-9 | 95% | 500MG |
¥ 2,600.00 | 2023-04-13 | |
| NAN JING YAO SHI KE JI GU FEN Co., Ltd. | PBTQ4968-1G |
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde |
885273-60-9 | 95% | 1g |
¥ 3,900.00 | 2023-04-13 |
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde Suppliers
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
Additional information on 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde
Comprehensive Guide to 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde (CAS No. 885273-60-9)
3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde (CAS No. 885273-60-9) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This oxazole derivative features a unique molecular structure combining a dimethylphenyl group with an oxazole-carbaldehyde moiety, making it particularly valuable for synthetic applications. Researchers frequently search for "3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde uses" and "CAS 885273-60-9 applications", reflecting growing interest in its potential.
The compound's chemical properties include a molecular weight of 201.22 g/mol and the characteristic reactivity of both aromatic systems and aldehyde functional groups. These features enable its participation in various organic synthesis reactions, particularly in constructing more complex heterocyclic systems. Current trends in "green chemistry alternatives" have increased demand for such versatile intermediates that can reduce synthetic steps in drug development.
In pharmaceutical applications, 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde serves as a key building block for potential therapeutic agents. The oxazole ring is known to exhibit diverse biological activities, and researchers are exploring its derivatives for "anti-inflammatory compounds" and "CNS-active molecules". The presence of both electron-donating methyl groups and the reactive aldehyde makes this compound particularly useful in structure-activity relationship studies.
The agrochemical industry has shown increasing interest in CAS 885273-60-9 for developing novel crop protection agents. With growing concerns about "sustainable pest control" and "environmentally friendly pesticides", this compound's structural features offer opportunities to create more selective and biodegradable formulations. The dimethylphenyl-oxazole scaffold may contribute to improved photostability and bioavailability in field applications.
From a synthetic chemistry perspective, the 3,5-dimethylphenyl substitution pattern provides steric and electronic effects that can influence reaction outcomes in valuable ways. Recent publications highlight its use in "multicomponent reactions" and as a precursor for "functionalized heterocycles". The aldehyde group's reactivity allows for diverse transformations including condensations, reductions, and nucleophilic additions.
Material scientists have begun investigating 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde for potential applications in organic electronics. The conjugated system formed by the oxazole and phenyl rings suggests possible utility in "OLED materials" or "molecular sensors". This aligns with current research trends toward "small molecule semiconductors" and "functional organic materials".
Quality control of CAS 885273-60-9 typically involves analytical techniques such as HPLC, NMR spectroscopy, and mass spectrometry. Purity specifications are crucial for research applications, with many laboratories searching for "high purity oxazole derivatives" and "certified reference standards". The compound's stability profile recommends storage under inert atmosphere at low temperatures.
The commercial availability of 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde has expanded in recent years to meet growing research demand. Suppliers often highlight its application in "medicinal chemistry research" and as a "versatile synthetic intermediate". Current market analysis shows increasing procurement for academic and industrial R&D programs worldwide.
Future research directions for this compound may explore its potential in "click chemistry applications" and as a "ligand in catalytic systems". The combination of structural features in 885273-60-9 offers numerous possibilities for innovation across chemical disciplines. Ongoing studies continue to reveal new aspects of its reactivity and potential applications.
For researchers working with 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde, proper handling procedures should be followed despite its non-hazardous classification. Standard laboratory practices including use of personal protective equipment are recommended when handling any chemical substance. The compound's material safety data sheet provides complete handling and storage guidelines.
In conclusion, 3-(3,5-dimethylphenyl)-1,2-oxazole-5-carbaldehyde (CAS No. 885273-60-9) represents an important chemical building block with diverse applications across multiple scientific disciplines. Its unique structural features continue to inspire research into new synthetic methodologies and functional materials, positioning it as a compound of ongoing interest in the scientific community.
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