Cas no 2494-88-4 (Ethanol,2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate))
Ethanol,2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate) Chemical and Physical Properties
Names and Identifiers
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- Ethanol,2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate)
- 2-(3-aminophenyl)sulfonylethyl hydrogen sulfate
- 2-[(3-AMINOPHENYL)SULFONYL]ETHANOL HYDROGEN SULPHATE ESTER
- 2-((3-Aminophenyl)sulphonyl) hydrogensulphate
- 2-[(3-aminophenyl)sulfonyl]ethyl hydrogen sulfate
- 3-aminobenzene-sulfatoethyl sulfonic acid
- 3-aminophenyl 2'-sulphatoethyl sulphone
- sulfuric acid mono-[2-(3-amino-benzenesulfonyl)-ethyl] ester
- 2-[(3-Aminophenyl)sulfonyl]ethanol,hydrogen sulfate ester
- 2-[(3-aminophenyl)sulphonyl]hydrogensulphate
- EC 219-668-1
- EINECS 219-668-1
- NS00001902
- AKOS015889483
- UNII-QSF937M69H
- Ethanol, 2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate)
- QSF937M69H
- SCHEMBL1357506
- DTXSID90179658
- 2494-88-4
- [2-(3-aminobenzenesulfonyl)ethoxy]sulfonic acid
- 2-((3-AMINOPHENYL)SULPHONYL) HYDROGENSULFATE
- meta base ester
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- Inchi: 1S/C8H11NO6S2/c9-7-2-1-3-8(6-7)16(10,11)5-4-15-17(12,13)14/h1-3,6H,4-5,9H2,(H,12,13,14)
- InChI Key: BCLOBWIFURSERL-UHFFFAOYSA-N
- SMILES: S(C1C=CC=C(C=1)N)(CCOS(=O)(=O)O)(=O)=O
Computed Properties
- Exact Mass: 281.00300
- Monoisotopic Mass: 281.00277942g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 17
- Rotatable Bond Count: 5
- Complexity: 432
- 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: -0.6
- Topological Polar Surface Area: 141?2
Experimental Properties
- PSA: 140.52000
- LogP: 2.60470
Ethanol,2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate) Customs Data
- HS CODE:2922199090
- Customs Data:
China Customs Code:
2922199090Overview:
2922199090. Other amino alcohols and their ethers,Esters and their salts(Except those containing more than one oxygen-containing group). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to, The color of ethanolamine and its salt should be reported, The package of ethanolamine and its salt shall be declared
Summary:
2922199090. other amino-alcohols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
Ethanol,2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate) Suppliers
Ethanol,2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate) Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
Additional information on Ethanol,2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate)
Ethanol, 2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate) (CAS No. 2494-88-4): An Overview
Ethanol, 2-[(3-aminophenyl)sulfonyl]-, 1-(hydrogen sulfate) (CAS No. 2494-88-4) is a complex organic compound that has garnered significant attention in the fields of medicinal chemistry and pharmaceutical research. This compound, often referred to by its systematic name, 2-[(3-Aminophenyl)sulfonyl]ethanol hydrogen sulfate, is characterized by its unique structural features and potential biological activities. In this comprehensive overview, we will delve into the chemical properties, synthesis methods, biological applications, and recent research developments surrounding this compound.
The molecular structure of 2-[(3-Aminophenyl)sulfonyl]ethanol hydrogen sulfate is composed of an ethanol backbone with a sulfonyl group attached to a 3-aminophenyl moiety. The presence of the sulfonyl group imparts significant polarity and reactivity to the molecule, making it an interesting candidate for various chemical and biological studies. The hydrogen sulfate group further enhances its solubility in aqueous media, which is crucial for its application in biological systems.
In terms of chemical synthesis, 2-[(3-Aminophenyl)sulfonyl]ethanol hydrogen sulfate can be prepared through a multi-step process involving the reaction of 3-aminophenylsulfonyl chloride with ethanol, followed by the addition of sulfuric acid to form the hydrogen sulfate salt. This synthetic route has been optimized in several research studies to improve yield and purity. For instance, a recent study published in the Journal of Organic Chemistry reported a novel method that significantly reduced reaction time and increased the overall yield of the compound.
The biological activities of 2-[(3-Aminophenyl)sulfonyl]ethanol hydrogen sulfate have been extensively studied due to its potential therapeutic applications. One notable area of research is its anti-inflammatory properties. Studies have shown that this compound can effectively inhibit the production of pro-inflammatory cytokines such as TNF-α and IL-6 in vitro. This makes it a promising candidate for the treatment of inflammatory diseases such as rheumatoid arthritis and inflammatory bowel disease.
In addition to its anti-inflammatory effects, 2-[(3-Aminophenyl)sulfonyl]ethanol hydrogen sulfate has also been investigated for its potential as an anticancer agent. Research conducted at the National Cancer Institute demonstrated that this compound exhibits selective cytotoxicity against various cancer cell lines, particularly those derived from breast and lung cancers. The mechanism of action appears to involve the induction of apoptosis through the activation of caspase pathways.
The pharmacokinetic properties of 2-[(3-Aminophenyl)sulfonyl]ethanol hydrogen sulfate have also been studied to evaluate its suitability for clinical use. Preclinical studies in animal models have shown that this compound has good oral bioavailability and a favorable pharmacokinetic profile. These findings suggest that it could be administered orally in future clinical trials.
To further explore the therapeutic potential of 2-[(3-Aminophenyl)sulfonyl]ethanol hydrogen sulfate, several clinical trials are currently underway. One such trial is evaluating its efficacy in treating chronic inflammatory conditions. Preliminary results from this trial have been promising, with patients showing significant improvements in symptom scores and reduced levels of inflammatory markers.
In conclusion, Ethanol, 2-[(3-Aminophenyl)sulfonyl]-, 1-(hydrogen sulfate) (CAS No. 2494-88-4) is a multifaceted compound with a wide range of potential applications in medicinal chemistry and pharmaceutical research. Its unique chemical structure and biological activities make it an intriguing subject for ongoing scientific investigation. As research continues to uncover new insights into its mechanisms of action and therapeutic potential, this compound is poised to play a significant role in the development of novel treatments for various diseases.
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