Cas no 4365-11-1 (4-(propan-2-yl)benzene-1-sulfonyl fluoride)
4-(propan-2-yl)benzene-1-sulfonyl fluoride Chemical and Physical Properties
Names and Identifiers
-
- benzenesulfonyl fluoride, 4-(1-methylethyl)-
- 4-Isopropylbenzenesulfonyl fluoride
- LogP
- 4-(1-Methylethyl)benzenesulfonyl fluoride
- 4-(propan-2-yl)benzene-1-sulfonyl fluoride
- 4-(Propan-2-yl)benzene-1-sulfonylfluoride
- AKOS022538357
- DTXSID30786683
- VS-0062
- SCHEMBL24810807
- 4365-11-1
- 4-propan-2-ylbenzenesulfonyl fluoride
- EN300-224420
-
- MDL: MFCD21882660
- Inchi: 1S/C9H11FO2S/c1-7(2)8-3-5-9(6-4-8)13(10,11)12/h3-7H,1-2H3
- InChI Key: OAEGHLYWVJNQGT-UHFFFAOYSA-N
- SMILES: S(C1C=CC(=CC=1)C(C)C)(=O)(=O)F
Computed Properties
- Exact Mass: 202.04643
- Monoisotopic Mass: 202.04637893g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 245
- 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: 3
- Topological Polar Surface Area: 42.5?2
Experimental Properties
- Density: 1.1607?at 25?°C
- Flash Point: Degrees Fahrenheit:>230°F
Degrees Celsius:>110°C - Refractive Index: n/D 1.4898
- PSA: 34.14
4-(propan-2-yl)benzene-1-sulfonyl fluoride Security Information
-
Symbol:
- Signal Word:Danger
- Hazard Statement: H314
- Warning Statement: P280-P303+P361+P353-P304+P340+P310-P305+P351+P338
- Hazardous Material transportation number:UN 3265 8 / PGII
- WGK Germany:3
- Hazard Category Code: 34
- Safety Instruction: 26-36/37/39-45
-
Hazardous Material Identification:
4-(propan-2-yl)benzene-1-sulfonyl fluoride Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd. | ALD00116-1G |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 1G |
496.66 | 2021-05-17 | ||
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 2035714-1g |
4-Isopropylbenzenesulfonyl fluoride |
4365-11-1 | 1g |
¥199.00 | 2024-05-13 | ||
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 2035714-5g |
4-Isopropylbenzenesulfonyl fluoride |
4365-11-1 | 5g |
¥500.00 | 2024-05-13 | ||
| Enamine | EN300-224420-0.1g |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 95% | 0.1g |
$376.0 | 2024-06-20 | |
| Enamine | EN300-224420-0.25g |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 95% | 0.25g |
$393.0 | 2024-06-20 | |
| Enamine | EN300-224420-0.5g |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 95% | 0.5g |
$410.0 | 2024-06-20 | |
| Enamine | EN300-224420-1.0g |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 95% | 1.0g |
$428.0 | 2024-06-20 | |
| Enamine | EN300-224420-2.5g |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 95% | 2.5g |
$838.0 | 2024-06-20 | |
| Enamine | EN300-224420-5.0g |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 95% | 5.0g |
$1240.0 | 2024-06-20 | |
| Enamine | EN300-224420-10.0g |
4-(propan-2-yl)benzene-1-sulfonyl fluoride |
4365-11-1 | 95% | 10.0g |
$1839.0 | 2024-06-20 |
4-(propan-2-yl)benzene-1-sulfonyl fluoride Related Literature
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
Additional information on 4-(propan-2-yl)benzene-1-sulfonyl fluoride
Benzenesulfonyl Fluoride, 4-(1-Methylethyl)-: A Comprehensive Overview
Benzenesulfonyl fluoride, 4-(1-methylethyl)- (CAS No: 4365-11-1) is a versatile organic compound with significant applications in various fields of chemistry and materials science. This compound, also referred to as 4-isopropylbenzenesulfonyl fluoride, belongs to the class of sulfonyl fluorides, which are widely recognized for their reactivity and utility in organic synthesis. The molecule consists of a benzene ring substituted with an isopropyl group at the para position and a sulfonyl fluoride group at the meta position relative to the isopropyl substituent.
The structure of benzenesulfonyl fluoride, 4-(1-methylethyl)- is characterized by its aromatic benzene ring, which provides stability and facilitates various chemical reactions. The sulfonyl fluoride group (-SO?F) is highly electrophilic due to the electron-withdrawing nature of the sulfone group, making it a valuable reagent in organic transformations. This compound has been extensively studied for its role in the synthesis of sulfonamides, which are critical intermediates in pharmaceutical chemistry and agrochemicals.
Recent advancements in synthetic chemistry have highlighted the importance of benzenesulfonyl fluoride, 4-(1-methylethyl)- in the development of novel drug delivery systems. Researchers have explored its ability to act as a reactive intermediate in the formation of bioactive molecules, particularly in the context of peptide coupling and medicinal chemistry. The compound's reactivity has been leveraged to design more efficient and selective catalysts for industrial applications.
In materials science, 4-isopropylbenzenesulfonyl fluoride has found applications in the synthesis of advanced polymers and high-performance materials. Its ability to undergo nucleophilic substitution reactions has made it a key component in the production of specialty polymers with tailored properties. Recent studies have demonstrated its potential in creating biodegradable polymers for use in biomedical applications, such as drug delivery vehicles and tissue engineering scaffolds.
The synthesis of benzenesulfonyl fluoride, 4-(1-methylethyl)- typically involves multi-step processes that require precise control over reaction conditions to ensure high yields and purity. Modern synthetic methods often incorporate green chemistry principles, minimizing environmental impact while maintaining efficiency. For instance, researchers have developed catalytic routes that reduce energy consumption and waste generation during the production of this compound.
From an analytical standpoint, benzenesulfonyl fluoride, 4-(1-methylethyl)- has been subjected to extensive spectroscopic studies to elucidate its electronic structure and reactivity patterns. Techniques such as X-ray crystallography and computational modeling have provided insights into its molecular geometry and bonding characteristics, which are crucial for understanding its chemical behavior.
In conclusion, benzenesulfonyl fluoride, 4-(1-methylethyl)- (CAS No: 4365-11-1) stands as a pivotal compound in contemporary chemical research and industry. Its unique properties and wide-ranging applications underscore its importance across diverse scientific disciplines. As research continues to uncover new avenues for its utilization, this compound is poised to play an even greater role in advancing both academic and industrial endeavors.
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