Cas no 4393-05-9 (2,4,5-TRIMETHYLBENZYL ALCOHOL)
2,4,5-TRIMETHYLBENZYL ALCOHOL Chemical and Physical Properties
Names and Identifiers
-
- 2,4,5-TRIMETHYLBENZYL ALCOHOL
- 2,4,5-Trimethyl-benzenemethanol
- Benzyl alcohol, 2,4,5-trimethyl-
- Pseudocumene-5-methylol
- α-Durenol
- Benzenemethanol, 2,4,5-trimethyl-
- (2,4,5-Trimethylphenyl)methanol #
- DTXSID90342643
- AKOS000125167
- CS-0452528
- 4393-05-9
- 2,5-dimethyl-4-methylbenzyl alcohol
- SCHEMBL394846
- .alpha.-Durenol
- (2,4,5-trimethyl-phenyl)-methanol
- (2,4,5-Trimethylphenyl)methanol
- GHDQBJLOOLNHCJ-UHFFFAOYSA-N
- (2,4,5-Trimethylphenyl)methanol, AldrichCPR
-
- MDL: MFCD00075864
- Inchi: 1S/C10H14O/c1-7-4-9(3)10(6-11)5-8(7)2/h4-5,11H,6H2,1-3H3
- InChI Key: GHDQBJLOOLNHCJ-UHFFFAOYSA-N
- SMILES: OCC1C=C(C)C(C)=CC=1C
Computed Properties
- Exact Mass: 150.10452
- Monoisotopic Mass: 150.104465066g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 122
- 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: 2.1
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
2,4,5-TRIMETHYLBENZYL ALCOHOL Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | T219475-2.5g |
2,4,5-Trimethylbenzyl alcohol |
4393-05-9 | 2.5g |
$ 45.00 | 2022-06-03 | ||
| TRC | T219475-5g |
2,4,5-Trimethylbenzyl alcohol |
4393-05-9 | 5g |
$ 60.00 | 2022-06-03 | ||
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1523195-100mg |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 98% | 100mg |
¥69.00 | 2024-05-13 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1523195-250mg |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 98% | 250mg |
¥117.00 | 2024-05-13 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1523195-1g |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 98% | 1g |
¥343.00 | 2024-05-13 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1523195-5g |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 98% | 5g |
¥1102.00 | 2024-05-13 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1523195-10g |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 98% | 10g |
¥1837.00 | 2024-05-13 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1523195-25g |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 98% | 25g |
¥3675.00 | 2024-05-13 | |
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 1523195-100g |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 98% | 100g |
¥9870.00 | 2024-05-13 | |
| Crysdot LLC | CD12071625-1g |
(2,4,5-Trimethylphenyl)methanol |
4393-05-9 | 97% | 1g |
$497 | 2024-07-24 |
2,4,5-TRIMETHYLBENZYL ALCOHOL Production Method
Production Method 1
2,4,5-TRIMETHYLBENZYL ALCOHOL Raw materials
2,4,5-TRIMETHYLBENZYL ALCOHOL Preparation Products
- 4-Methylbenzyl alcohol (589-18-4)
- 2-Ethyl-1,4-dimethylbenzene (1758-88-9)
- Guaiacol (90-05-1)
- 2-Methoxy-3,4,5-trimethylphenol (1195652-69-7)
- 4-Ethylbenzyl alcohol (768-59-2)
- 1-Ethyl-2,4-dimethylbenzene (874-41-9)
- 3-Ethyltoluene (620-14-4)
- [(E)-prop-1-enyl]benzene (300-57-2)
- 4-ethenyl-1,2-dimethylbenzene (27831-13-6)
- Benzyl alcohol (100-51-6)
- 2,4,5-TRIMETHYLBENZYL ALCOHOL (4393-05-9)
- 2-Methoxy-4-propylphenol (2785-87-7)
- 4-Ethylguaiacol (2785-89-9)
- 2-Methylbenzyl alcohol (89-95-2)
2,4,5-TRIMETHYLBENZYL ALCOHOL Suppliers
2,4,5-TRIMETHYLBENZYL ALCOHOL Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
Additional information on 2,4,5-TRIMETHYLBENZYL ALCOHOL
Introduction to 2,4,5-TRIMETHYLBENZYL ALCOHOL (CAS No. 4393-05-9)
2,4,5-TRIMETHYLBENZYL ALCOHOL, identified by the Chemical Abstracts Service Number (CAS No.) 4393-05-9, is a significant organic compound that has garnered attention in the field of pharmaceutical chemistry and material science. This compound, characterized by its trimethyl-substituted benzyl alcohol structure, exhibits unique chemical properties that make it valuable in various applications, particularly in the synthesis of fine chemicals and as an intermediate in pharmaceutical formulations.
The molecular structure of 2,4,5-TRIMETHYLBENZYL ALCOHOL consists of a benzene ring substituted with three methyl groups at the 2nd, 4th, and 5th positions, along with a hydroxyl group attached to a benzylic carbon. This specific arrangement imparts distinct reactivity and solubility characteristics, making it a versatile building block in organic synthesis. The compound’s stability under various conditions and its ability to participate in multiple chemical reactions further enhance its utility in industrial and research settings.
In recent years, research has highlighted the potential of 2,4,5-TRIMETHYLBENZYL ALCOHOL as a precursor in the development of novel pharmaceutical agents. Its benzylic alcohol moiety can undergo various transformations, including oxidation to form aldehydes or carboxylic acids, or reduction to yield alkanes. These transformations are crucial in drug synthesis, where precise control over functional group interconversions is essential for achieving desired pharmacological properties.
One of the most notable applications of 2,4,5-TRIMETHYLBENZYL ALCOHOL is in the field of medicinal chemistry. Researchers have explored its role in synthesizing bioactive molecules that exhibit antimicrobial and anti-inflammatory properties. For instance, derivatives of this compound have been investigated for their potential to inhibit enzymes involved in pathogenic processes. The structural flexibility offered by the trimethylbenzyl group allows for modifications that can fine-tune the biological activity of resulting compounds.
Moreover, the chemical industry has leveraged 2,4,5-TRIMETHYLBENZYL ALCOHOL for producing specialty chemicals used in fragrances and flavors. Its aromatic nature and the presence of hydroxyl functionality contribute to its role as an intermediate in synthesizing esters and other aromatic compounds that are widely used in perfumery and food additives. The compound’s compatibility with various solvent systems also makes it suitable for industrial-scale reactions where solubility and reaction efficiency are critical parameters.
The synthesis of 2,4,5-TRIMETHYLBENZYL ALCOHOL typically involves Friedel-Crafts alkylation followed by hydroxylation steps. Advanced synthetic methodologies have been developed to improve yield and purity, ensuring that the compound meets stringent quality standards required for pharmaceutical applications. Techniques such as catalytic hydrogenation and selective oxidation have been optimized to produce high-purity 2,4,5-TRIMETHYLBENZYL ALCOHOL efficiently.
Recent studies have also delved into the environmental impact of using 2,4,5-TRIMETHYLBENZYL ALCOHOL as a chemical intermediate. Efforts have been made to develop greener synthetic routes that minimize waste generation and reduce reliance on hazardous reagents. These sustainable practices align with global initiatives aimed at promoting environmentally friendly chemical manufacturing processes.
The pharmacological potential of 2,4,5-TRIMETHYLBENZYL ALCOHOL continues to be an area of active investigation. Researchers are exploring its role in developing treatments for neurological disorders by examining how its structural analogs interact with biological targets. Preliminary findings suggest that certain derivatives may modulate neurotransmitter activity without significant side effects.
In conclusion,2,4,5-TRIMETHYLBENZYL ALCOHOL (CAS No. 4393-05-9) is a multifaceted compound with broad applications across pharmaceuticals and industrial chemistry. Its unique structural features enable diverse chemical transformations that make it indispensable in drug development and fine chemical synthesis. As research progresses,the full potential of this compound is expected to be further unlocked,leading to innovative solutions in medicine and material science.
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