1-Bromo-4-(methylsulphonyl)benzene
TL;DR: 1-Bromo-4-(methylsulphonyl)benzene (CAS 3466-32-8) is a chemical compound with molecular formula C7H7BrO2S and molecular weight 233.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-4-methylsulfonylbenzene
Also Known As: 4-Bromophenyl methyl sulfone, 1-Bromo-4-(methylsulfonyl)benzene, p-Bromophenyl methyl sulfone, 1-bromo-4-methylsulfonylbenzene, Benzene, 1-bromo-4-(methylsulfonyl)-
| Molecular Formula | C7H7BrO2S |
|---|---|
| Molecular Weight | 233.94 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.93501 |
| Heavy Atoms | 11 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 3466-32-8 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC=C(C=C1)Br |
| InChIKey | FJLFSYRGFJDJMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Bromo-4-(methylsulphonyl)benzene (CAS 3466-32-8), with molecular formula C7H7BrO2S and molecular weight 233.94 g/mol. IUPAC: 1-bromo-4-methylsulfonylbenzene.
Chemical Property Profile of 1-Bromo-4-(methylsulphonyl)benzene
Property Insights of 1-Bromo-4-(methylsulphonyl)benzene
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-4-(methylsulphonyl)benzene. With a topological polar surface area (TPSA) of 42.5 Ų, 1-Bromo-4-(methylsulphonyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-4-(methylsulphonyl)benzene has 0 hydrogen bond donor(s) and 2 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 1-Bromo-4-(methylsulphonyl)benzene?
The CAS number of 1-Bromo-4-(methylsulphonyl)benzene is 3466-32-8.
What is the molecular formula of 1-Bromo-4-(methylsulphonyl)benzene?
The molecular formula of 1-Bromo-4-(methylsulphonyl)benzene is C7H7BrO2S.
What is the molecular weight of 1-Bromo-4-(methylsulphonyl)benzene?
The molecular weight of 1-Bromo-4-(methylsulphonyl)benzene is 233.94 g/mol.
Where can I buy 1-Bromo-4-(methylsulphonyl)benzene?
You can request a quote for 1-Bromo-4-(methylsulphonyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-4-(methylsulphonyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-4-(methylsulphonyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.