1-Bromo-2-((methylsulfonyl)methyl)benzene
TL;DR: 1-Bromo-2-((methylsulfonyl)methyl)benzene (CAS 25195-52-2) is a chemical compound with molecular formula C8H9BrO2S and molecular weight 247.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-(methylsulfonylmethyl)benzene
Also Known As: 1-bromo-2-((methylsulfonyl)methyl)benzene, 2-Bromobenzylmethylsulfone, Not Available, 2-bromobenzylthiol, 1-bromo-2-(methylsulfonylmethyl)benzene
| Molecular Formula | C8H9BrO2S |
|---|---|
| Molecular Weight | 247.95 g/mol |
| LogP | 1.9937 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.95065 |
| Heavy Atoms | 12 |
| Complexity | 370.39917 |
Chemical Identifiers
| CAS Number | 25195-52-2 |
|---|---|
| SMILES | CS(=O)(=O)CC1=CC=CC=C1Br |
Product Overview
1-Bromo-2-((methylsulfonyl)methyl)benzene (CAS 25195-52-2), with molecular formula C8H9BrO2S and molecular weight 247.95 g/mol. IUPAC: 1-bromo-2-(methylsulfonylmethyl)benzene.
Chemical Property Profile of 1-Bromo-2-((methylsulfonyl)methyl)benzene
Property Insights of 1-Bromo-2-((methylsulfonyl)methyl)benzene
The XLogP value of 1.9937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Bromo-2-((methylsulfonyl)methyl)benzene. With a topological polar surface area (TPSA) of 34.14 Ų, 1-Bromo-2-((methylsulfonyl)methyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-((methylsulfonyl)methyl)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-2-((methylsulfonyl)methyl)benzene?
The CAS number of 1-Bromo-2-((methylsulfonyl)methyl)benzene is 25195-52-2.
What is the molecular formula of 1-Bromo-2-((methylsulfonyl)methyl)benzene?
The molecular formula of 1-Bromo-2-((methylsulfonyl)methyl)benzene is C8H9BrO2S.
What is the molecular weight of 1-Bromo-2-((methylsulfonyl)methyl)benzene?
The molecular weight of 1-Bromo-2-((methylsulfonyl)methyl)benzene is 247.95 g/mol.
Where can I buy 1-Bromo-2-((methylsulfonyl)methyl)benzene?
You can request a quote for 1-Bromo-2-((methylsulfonyl)methyl)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-2-((methylsulfonyl)methyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-((methylsulfonyl)methyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.