80-40-0 | Ethyl p-toluenesulfonate

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$16.00	$11.00
5g	95%	in stock	$20.00	$14.00
10g	95%	in stock	$23.00	$16.00
25g	95%	in stock	$26.00	$18.00
100g	95%	in stock	$60.00	$42.00
500g	95%	in stock	$111.00	$78.00

Description

• Catalog Number: AB73874
• Chemical Name: Ethyl p-toluenesulfonate
• CAS Number: 80-40-0
• Molecular Formula: C9H12O3S
• Molecular Weight: 200.2548
• MDL Number: MFCD20691064
• SMILES: CCOS(=O)(=O)c1ccc(cc1)C
• NSC Number: 8887

Computed Properties

• Complexity: 232
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• XLogP3: 1.8

Literature

• Design and synthesis of an ¹⁸F-labeled version of phenylethyl orvinol ([¹⁸F]FE-PEO) for PET-imaging of opioid receptors.

  Molecules (Basel, Switzerland) 20120928

• A Sensitive and Simple HPLC-UV Method for Trace Level Quantification of Ethyl p-Toluenesulfonate and Methyl p-Toluenesulfonate, Two Potential Genotoxins in Active Pharmaceutical Ingredients.

  Scientia pharmaceutica 20110101

• Determining the transition-state structure for different SN2 reactions using experimental nucleophile carbon and secondary alpha-deuterium kinetic isotope effects and theory.

  The journal of physical chemistry. A 20081016

• Synthesis and Biological Analysis of Thiotetra(ethylene glycol) monomethyl Ether-Functionalized Porphyrazines: Cellular Uptake and Toxicity Studies.

  Metal-based drugs 20080101

• Theory and use of the pseudophase model in gas-liquid chromatographic enantiomeric separations.

  Analytical chemistry 20060101

• Structure-activity considerations and in vitro approaches to assess the genotoxicity of 19 methane-, benzene- and toluenesulfonic acid esters.

  Mutation research 20050307

• Development of a new radioligand, N-(5-fluoro-2-phenoxyphenyl)-N-(2-[18F]fluoroethyl-5-methoxybenzyl)acetamide, for pet imaging of peripheral benzodiazepine receptor in primate brain.

  Journal of medicinal chemistry 20040422