Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-
TL;DR: Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- (CAS 98475-05-9) is a chemical compound with molecular formula C15H13BrO4S and molecular weight 367.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-oxoethyl] 4-methylbenzenesulfonate
Also Known As: 4'-bromophenacyl p-toluenesulfonate, 4 -Bromo-alpha-(tosyloxy)acetophenone, alpha-(Tosyloxy)-4 -bromoacetophenone, 2-(Tosyloxy)-1-(4-bromophenyl)ethanone, p-Toluenesulfonic acid 4-bromophenacyl ester
| Molecular Formula | C15H13BrO4S |
|---|---|
| Molecular Weight | 367.97 g/mol |
| LogP | 3.34572 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.9718 |
| Heavy Atoms | 21 |
| Complexity | 734.248 |
Chemical Identifiers
| CAS Number | 98475-05-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OCC(=O)C2=CC=C(C=C2)Br |
Product Overview
Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- (CAS 98475-05-9), with molecular formula C15H13BrO4S and molecular weight 367.97 g/mol. IUPAC: [2-(4-bromophenyl)-2-oxoethyl] 4-methylbenzenesulfonate.
Chemical Property Profile of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-
Property Insights of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-
The XLogP value of 3.34572 indicates that Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-. Following Lipinski's Rule of Five, Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-?
The CAS number of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- is 98475-05-9.
What is the molecular formula of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-?
The molecular formula of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- is C15H13BrO4S.
What is the molecular weight of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-?
The molecular weight of Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- is 367.97 g/mol.
Where can I buy Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-?
You can request a quote for Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4-bromophenyl)-2-[[(4-methylphenyl)sulfonyl]oxy]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.