Isopropylsulfinic acid, isopropyl ester
TL;DR: Isopropylsulfinic acid, isopropyl ester (CAS 22598-57-8) is a chemical compound with molecular formula C6H14O2S and molecular weight 150.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl propane-2-sulfinate
Also Known As: O-isopropyl isopropanesulphinate, propan-2-yl propane-2-sulfinate, Isopropylsulfinic acid, isopropyl ester
| Molecular Formula | C6H14O2S |
|---|---|
| Molecular Weight | 150.07 g/mol |
| LogP | 1.4835 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.07146 |
| Heavy Atoms | 9 |
| Complexity | 99.23098 |
Chemical Identifiers
| CAS Number | 22598-57-8 |
|---|---|
| SMILES | CC(C)OS(=O)C(C)C |
Product Overview
Isopropylsulfinic acid, isopropyl ester (CAS 22598-57-8), with molecular formula C6H14O2S and molecular weight 150.07 g/mol. IUPAC: propan-2-yl propane-2-sulfinate.
Chemical Property Profile of Isopropylsulfinic acid, isopropyl ester
Property Insights of Isopropylsulfinic acid, isopropyl ester
The XLogP value of 1.4835 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropylsulfinic acid, isopropyl ester. With a topological polar surface area (TPSA) of 26.3 Ų, Isopropylsulfinic acid, isopropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropylsulfinic acid, isopropyl ester 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 Isopropylsulfinic acid, isopropyl ester?
The CAS number of Isopropylsulfinic acid, isopropyl ester is 22598-57-8.
What is the molecular formula of Isopropylsulfinic acid, isopropyl ester?
The molecular formula of Isopropylsulfinic acid, isopropyl ester is C6H14O2S.
What is the molecular weight of Isopropylsulfinic acid, isopropyl ester?
The molecular weight of Isopropylsulfinic acid, isopropyl ester is 150.07 g/mol.
Where can I buy Isopropylsulfinic acid, isopropyl ester?
You can request a quote for Isopropylsulfinic acid, isopropyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isopropylsulfinic acid, isopropyl ester?
Yes, KEHONG BIO provides custom synthesis services for Isopropylsulfinic acid, isopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.