Methyl vinyl sulfone
TL;DR: Methyl vinyl sulfone (CAS 3680-02-2) is a chemical compound with molecular formula C3H6O2S and molecular weight 106.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonylethene
Also Known As: Methyl vinyl sulfone, methanesulfonylethene, Methyl vinyl sulphone, Ethene, (methylsulfonyl)-, Methylvinylsulfone
| Molecular Formula | C3H6O2S |
|---|---|
| Molecular Weight | 106.01 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 42.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 106.00885 |
| Heavy Atoms | 6 |
| Complexity | 125.0 |
| Boiling Point | 252 to 123.9 °C at 24 mmHg |
| Density | 1.2117 at 20.0 °C |
| Solubility | 10 to 50 mg/mL at 63 °F (NTP, 1992) |
| Flash Point | greater than 110.0 °C |
Chemical Identifiers
| CAS Number | 3680-02-2 |
|---|---|
| SMILES | CS(=O)(=O)C=C |
| InChIKey | WUIJTQZXUURFQU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl vinyl sulfone (CAS 3680-02-2), with molecular formula C3H6O2S and molecular weight 106.01 g/mol. IUPAC: 1-methylsulfonylethene.
Chemical Property Profile of Methyl vinyl sulfone
Property Insights of Methyl vinyl sulfone
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl vinyl sulfone. With a topological polar surface area (TPSA) of 42.5 Ų, Methyl vinyl sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 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 Methyl vinyl sulfone?
The CAS number of Methyl vinyl sulfone is 3680-02-2.
What is the molecular formula of Methyl vinyl sulfone?
The molecular formula of Methyl vinyl sulfone is C3H6O2S.
What is the molecular weight of Methyl vinyl sulfone?
The molecular weight of Methyl vinyl sulfone is 106.01 g/mol.
Where can I buy Methyl vinyl sulfone?
You can request a quote for Methyl vinyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl vinyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for Methyl vinyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.