2-丙烯-1-基甲磺酸酯
TL;DR: 2-丙烯-1-基甲磺酸酯 (CAS 6728-21-8) is a chemical compound with molecular formula C4H8O3S and molecular weight 136.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-丙烯-1-基甲磺酸酯
prop-2-enyl methanesulfonate
Also Known As: Allyl methanesulfonate, Allyl mesylate, prop-2-en-1-yl methanesulfonate, mesyl allyl ether, allylmethanesulfonate
| Molecular Formula | C4H8O3S |
|---|---|
| Molecular Weight | 136.02 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 136.01941 |
| Heavy Atoms | 8 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 6728-21-8 |
|---|---|
| SMILES | CS(=O)(=O)OCC=C |
| InChIKey | SUDMKGNNRMLBMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-丙烯-1-基甲磺酸酯 (CAS 6728-21-8), with molecular formula C4H8O3S and molecular weight 136.02 g/mol. IUPAC: prop-2-enyl methanesulfonate.
Chemical Property Profile of 2-丙烯-1-基甲磺酸酯
Property Insights of 2-丙烯-1-基甲磺酸酯
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-丙烯-1-基甲磺酸酯. With a topological polar surface area (TPSA) of 51.8 Ų, 2-丙烯-1-基甲磺酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-丙烯-1-基甲磺酸酯 has 0 hydrogen bond donor(s) and 3 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 2-丙烯-1-基甲磺酸酯?
The CAS number of 2-丙烯-1-基甲磺酸酯 is 6728-21-8.
What is the molecular formula of 2-丙烯-1-基甲磺酸酯?
The molecular formula of 2-丙烯-1-基甲磺酸酯 is C4H8O3S.
What is the molecular weight of 2-丙烯-1-基甲磺酸酯?
The molecular weight of 2-丙烯-1-基甲磺酸酯 is 136.02 g/mol.
Where can I buy 2-丙烯-1-基甲磺酸酯?
You can request a quote for 2-丙烯-1-基甲磺酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-丙烯-1-基甲磺酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2-丙烯-1-基甲磺酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.