4-Fluorobenzylmethylsulfone
TL;DR: 4-Fluorobenzylmethylsulfone (CAS 5925-83-7) is a chemical compound with molecular formula C8H9FO2S and molecular weight 188.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-4-(methylsulfonylmethyl)benzene
Also Known As: 4-Fluorobenzylmethylsulfone, 4-fluorobenzyl methyl sulfone, 1-fluoro-4-(methylsulfonylmethyl)benzene, Sulfone, p-fluorobenzyl methyl, (4-Fluor-benzyl)-methyl-sulfon
| Molecular Formula | C8H9FO2S |
|---|---|
| Molecular Weight | 188.03 g/mol |
| LogP | 1.3703 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.03073 |
| Heavy Atoms | 12 |
| Complexity | 353.14917 |
Chemical Identifiers
| CAS Number | 5925-83-7 |
|---|---|
| SMILES | CS(=O)(=O)CC1=CC=C(C=C1)F |
Product Overview
4-Fluorobenzylmethylsulfone (CAS 5925-83-7), with molecular formula C8H9FO2S and molecular weight 188.03 g/mol. IUPAC: 1-fluoro-4-(methylsulfonylmethyl)benzene.
Chemical Property Profile of 4-Fluorobenzylmethylsulfone
Property Insights of 4-Fluorobenzylmethylsulfone
The XLogP value of 1.3703 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluorobenzylmethylsulfone. With a topological polar surface area (TPSA) of 34.14 Ų, 4-Fluorobenzylmethylsulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluorobenzylmethylsulfone 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 4-Fluorobenzylmethylsulfone?
The CAS number of 4-Fluorobenzylmethylsulfone is 5925-83-7.
What is the molecular formula of 4-Fluorobenzylmethylsulfone?
The molecular formula of 4-Fluorobenzylmethylsulfone is C8H9FO2S.
What is the molecular weight of 4-Fluorobenzylmethylsulfone?
The molecular weight of 4-Fluorobenzylmethylsulfone is 188.03 g/mol.
Where can I buy 4-Fluorobenzylmethylsulfone?
You can request a quote for 4-Fluorobenzylmethylsulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluorobenzylmethylsulfone?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluorobenzylmethylsulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.