2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol
TL;DR: 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol (CAS 76567-41-4) is a chemical compound with molecular formula C6H12O4S and molecular weight 180.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-dioxooxathiolan-3-yl)propan-2-ol
Also Known As: 2-(2,2-dioxido-1,2-oxathiolan-3-yl)propan-2-ol, 2-(2,2-dioxooxathiolan-3-yl)propan-2-ol, 3-(2-Hydroxypropan-2-yl)-1,2lambda~6~-oxathiolane-2,2-dione, RefChem:250039
| Molecular Formula | C6H12O4S |
|---|---|
| Molecular Weight | 180.05 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 180.04562 |
| Heavy Atoms | 11 |
| Complexity | 236.0 |
Chemical Identifiers
| CAS Number | 76567-41-4 |
|---|---|
| SMILES | CC(C)(C1CCOS1(=O)=O)O |
| InChIKey | FYYMTXSJMJTFSM-UHFFFAOYSA-N |
Product Overview
2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol (CAS 76567-41-4), with molecular formula C6H12O4S and molecular weight 180.05 g/mol. IUPAC: 2-(2,2-dioxooxathiolan-3-yl)propan-2-ol.
Chemical Property Profile of 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol
Property Insights of 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol. Following Lipinski's Rule of Five, 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol has 1 hydrogen bond donor(s) and 4 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-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol?
The CAS number of 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol is 76567-41-4.
What is the molecular formula of 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol?
The molecular formula of 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol is C6H12O4S.
What is the molecular weight of 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol?
The molecular weight of 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol is 180.05 g/mol.
Where can I buy 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol?
You can request a quote for 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2-Dioxido-1,2-oxathiolan-3-yl)propan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.