丙基甲磺酸酯
TL;DR: 丙基甲磺酸酯 (CAS 1912-31-8) is a chemical compound with molecular formula C4H10O3S and molecular weight 138.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丙基甲磺酸酯
propyl methanesulfonate
Also Known As: Propyl methanesulfonate, Propyl methanesulphonate, n-Propyl methanesulfonate, propyl mesylate, Methanesulfonic acid, propyl ester
| Molecular Formula | C4H10O3S |
|---|---|
| Molecular Weight | 138.04 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 138.03506 |
| Heavy Atoms | 8 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 1912-31-8 |
|---|---|
| SMILES | CCCOS(=O)(=O)C |
| InChIKey | DKORSYDQYFVQNS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丙基甲磺酸酯 (CAS 1912-31-8), with molecular formula C4H10O3S and molecular weight 138.04 g/mol. IUPAC: propyl methanesulfonate.
Chemical Property Profile of 丙基甲磺酸酯
Property Insights of 丙基甲磺酸酯
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丙基甲磺酸酯. With a topological polar surface area (TPSA) of 51.8 Ų, 丙基甲磺酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丙基甲磺酸酯 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 丙基甲磺酸酯?
The CAS number of 丙基甲磺酸酯 is 1912-31-8.
What is the molecular formula of 丙基甲磺酸酯?
The molecular formula of 丙基甲磺酸酯 is C4H10O3S.
What is the molecular weight of 丙基甲磺酸酯?
The molecular weight of 丙基甲磺酸酯 is 138.04 g/mol.
Where can I buy 丙基甲磺酸酯?
You can request a quote for 丙基甲磺酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丙基甲磺酸酯?
Yes, KEHONG BIO provides custom synthesis services for 丙基甲磺酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.