Phenyl vinyl sulfone
TL;DR: Phenyl vinyl sulfone (CAS 5535-48-8) is a chemical compound with molecular formula C8H8O2S and molecular weight 168.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenylsulfonylbenzene
Also Known As: Phenyl vinyl sulfone, (Vinylsulfonyl)benzene, Vinylsulfonylbenzene, (ethenylsulfonyl)benzene, ethenylsulfonylbenzene
| Molecular Formula | C8H8O2S |
|---|---|
| Molecular Weight | 168.02 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.0245 |
| Heavy Atoms | 11 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 5535-48-8 |
|---|---|
| SMILES | C=CS(=O)(=O)C1=CC=CC=C1 |
| InChIKey | UJTPZISIAWDGFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenyl vinyl sulfone (CAS 5535-48-8), with molecular formula C8H8O2S and molecular weight 168.02 g/mol. IUPAC: ethenylsulfonylbenzene.
Chemical Property Profile of Phenyl vinyl sulfone
Property Insights of Phenyl vinyl sulfone
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl vinyl sulfone. With a topological polar surface area (TPSA) of 42.5 Ų, Phenyl vinyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl vinyl sulfone 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 Phenyl vinyl sulfone?
The CAS number of Phenyl vinyl sulfone is 5535-48-8.
What is the molecular formula of Phenyl vinyl sulfone?
The molecular formula of Phenyl vinyl sulfone is C8H8O2S.
What is the molecular weight of Phenyl vinyl sulfone?
The molecular weight of Phenyl vinyl sulfone is 168.02 g/mol.
Where can I buy Phenyl vinyl sulfone?
You can request a quote for Phenyl vinyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl vinyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for Phenyl vinyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.