(2S)-1-methylsulfonylsulfanylpropan-2-ol
TL;DR: (2S)-1-methylsulfonylsulfanylpropan-2-ol (CAS 31534-22-2) 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.
(2S)-1-methylsulfonylsulfanylpropan-2-ol
Also Known As: 2-Hydroxypropyl methanethiosulphonate, (2S)-1-methylsulfonylsulfanylpropan-2-ol, s-[(2s)-2-hydroxypropyl] methanesulfonothioate, Thiosulfuric acid, S-methyl O-propyl ester, Methanesulfonothioic acid, S-(2-hydroxypropyl) ester
| Molecular Formula | C4H10O3S2 |
|---|---|
| Molecular Weight | 170.01 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.00714 |
| Heavy Atoms | 9 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 31534-22-2 |
|---|---|
| SMILES | C[C@@H](CSS(=O)(=O)C)O |
| InChIKey | CYRYBYQBGSMZMK-BYPYZUCNSA-N |
Product Overview
(2S)-1-methylsulfonylsulfanylpropan-2-ol (CAS 31534-22-2), with molecular formula C4H10O3S2 and molecular weight 170.01 g/mol. IUPAC: (2S)-1-methylsulfonylsulfanylpropan-2-ol.
Chemical Property Profile of (2S)-1-methylsulfonylsulfanylpropan-2-ol
Property Insights of (2S)-1-methylsulfonylsulfanylpropan-2-ol
The XLogP value of -0.2 indicates that (2S)-1-methylsulfonylsulfanylpropan-2-ol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-1-methylsulfonylsulfanylpropan-2-ol. Following Lipinski's Rule of Five, (2S)-1-methylsulfonylsulfanylpropan-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 (2S)-1-methylsulfonylsulfanylpropan-2-ol?
The CAS number of (2S)-1-methylsulfonylsulfanylpropan-2-ol is 31534-22-2.
What is the molecular formula of (2S)-1-methylsulfonylsulfanylpropan-2-ol?
The molecular formula of (2S)-1-methylsulfonylsulfanylpropan-2-ol is C4H10O3S2.
What is the molecular weight of (2S)-1-methylsulfonylsulfanylpropan-2-ol?
The molecular weight of (2S)-1-methylsulfonylsulfanylpropan-2-ol is 170.01 g/mol.
Where can I buy (2S)-1-methylsulfonylsulfanylpropan-2-ol?
You can request a quote for (2S)-1-methylsulfonylsulfanylpropan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-1-methylsulfonylsulfanylpropan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for (2S)-1-methylsulfonylsulfanylpropan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.