2-Hydroxypropyl methanethiolsulfonate
TL;DR: 2-Hydroxypropyl methanethiolsulfonate (CAS 41206-16-0) is a chemical compound with molecular formula C4H10O3S2 and molecular weight 170.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonothioyloxypropan-2-ol
Also Known As: Hpmts, 2-Hydroxypropyl methanethiolsulfonate, 2-Hydroxypropyl methanethiosulfonate, 1-methylsulfonothioyloxypropan-2-ol, 2-hydroxypropylmethylthiosulfonate
| Molecular Formula | C4H10O3S2 |
|---|---|
| Molecular Weight | 170.01 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.00714 |
| Heavy Atoms | 9 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 41206-16-0 |
|---|---|
| SMILES | CC(COS(=O)(=S)C)O |
| InChIKey | MHKJBDXQSICTIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Hydroxypropyl methanethiolsulfonate (CAS 41206-16-0), with molecular formula C4H10O3S2 and molecular weight 170.01 g/mol. IUPAC: 1-methylsulfonothioyloxypropan-2-ol.
Chemical Property Profile of 2-Hydroxypropyl methanethiolsulfonate
Property Insights of 2-Hydroxypropyl methanethiolsulfonate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxypropyl methanethiolsulfonate. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxypropyl methanethiolsulfonate. Following Lipinski's Rule of Five, 2-Hydroxypropyl methanethiolsulfonate 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-Hydroxypropyl methanethiolsulfonate?
The CAS number of 2-Hydroxypropyl methanethiolsulfonate is 41206-16-0.
What is the molecular formula of 2-Hydroxypropyl methanethiolsulfonate?
The molecular formula of 2-Hydroxypropyl methanethiolsulfonate is C4H10O3S2.
What is the molecular weight of 2-Hydroxypropyl methanethiolsulfonate?
The molecular weight of 2-Hydroxypropyl methanethiolsulfonate is 170.01 g/mol.
Where can I buy 2-Hydroxypropyl methanethiolsulfonate?
You can request a quote for 2-Hydroxypropyl methanethiolsulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxypropyl methanethiolsulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxypropyl methanethiolsulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.