甲基磺酸异丙酯
TL;DR: 甲基磺酸异丙酯 (CAS 926-06-7) 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.
甲基磺酸异丙酯
propan-2-yl methanesulfonate
Also Known As: ISOPROPYL METHANESULFONATE, Isopropyl mesylate, Isopropylmethanesulfonate, propan-2-yl methanesulfonate, Isopropyl methane sulphonate
| Molecular Formula | C4H10O3S |
|---|---|
| Molecular Weight | 138.04 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 138.03506 |
| Heavy Atoms | 8 |
| Complexity | 139.0 |
| Boiling Point | 82 °C at 6 mm Hg |
| Density | 1.145 |
| Vapor Pressure | 0.43 [mmHg] |
Chemical Identifiers
| CAS Number | 926-06-7 |
|---|---|
| SMILES | CC(C)OS(=O)(=O)C |
| InChIKey | SWWHCQCMVCPLEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基磺酸异丙酯 (CAS 926-06-7), with molecular formula C4H10O3S and molecular weight 138.04 g/mol. IUPAC: propan-2-yl methanesulfonate.
Chemical Property Profile of 甲基磺酸异丙酯
Property Insights of 甲基磺酸异丙酯
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基磺酸异丙酯. With a topological polar surface area (TPSA) of 51.8 Ų, 甲基磺酸异丙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基磺酸异丙酯 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 甲基磺酸异丙酯?
The CAS number of 甲基磺酸异丙酯 is 926-06-7.
What is the molecular formula of 甲基磺酸异丙酯?
The molecular formula of 甲基磺酸异丙酯 is C4H10O3S.
What is the molecular weight of 甲基磺酸异丙酯?
The molecular weight of 甲基磺酸异丙酯 is 138.04 g/mol.
Where can I buy 甲基磺酸异丙酯?
You can request a quote for 甲基磺酸异丙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基磺酸异丙酯?
Yes, KEHONG BIO provides custom synthesis services for 甲基磺酸异丙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.