Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-
TL;DR: Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- (CAS 83642-28-8) is a chemical compound with molecular formula C13H11BrO3S and molecular weight 325.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromophenoxy)-4-methylsulfonylbenzene
Also Known As: 1-(4-bromophenoxy)-4-methanesulfonylbenzene, 1- -4-methanesulfonylbenzene, 1-Bromo-4-(4-(methylsulfonyl)phenoxy)benzene, Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-, 1-(4-bromophenoxy)-4-methylsulfonylbenzene
| Molecular Formula | C13H11BrO3S |
|---|---|
| Molecular Weight | 325.96 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 325.96124 |
| Heavy Atoms | 18 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 83642-28-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)OC2=CC=C(C=C2)Br |
| InChIKey | UTOBNWJHJAXJFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- (CAS 83642-28-8), with molecular formula C13H11BrO3S and molecular weight 325.96 g/mol. IUPAC: 1-(4-bromophenoxy)-4-methylsulfonylbenzene.
Chemical Property Profile of Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-
Property Insights of Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-
The XLogP value of 3.0 indicates that Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- has 0 hydrogen bond donor(s) and 3 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 Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-?
The CAS number of Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- is 83642-28-8.
What is the molecular formula of Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-?
The molecular formula of Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- is C13H11BrO3S.
What is the molecular weight of Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-?
The molecular weight of Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- is 325.96 g/mol.
Where can I buy Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-?
You can request a quote for Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1-bromo-4-(4-(methylsulfonyl)phenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.