3-((2-Hydroxyethyl)thio)-1,2-propanediol
TL;DR: 3-((2-Hydroxyethyl)thio)-1,2-propanediol (CAS 1468-40-2) is a chemical compound with molecular formula C5H12O3S and molecular weight 152.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxyethylsulfanyl)propane-1,2-diol
Also Known As: 3-[thio]propane-1,2-diol, 3-(2-Hydroxyethylthio)propane-1,2-diol, 3-[ thio]propane-1,2-diol, 3-((2-Hydroxyethyl)thio)-1,2-propanediol, 1-(2-hydroxyethylthio)-2,3-propanediol
| Molecular Formula | C5H12O3S |
|---|---|
| Molecular Weight | 152.05 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 86.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 152.05072 |
| Heavy Atoms | 9 |
| Complexity | 60.0 |
Chemical Identifiers
| CAS Number | 1468-40-2 |
|---|---|
| SMILES | C(CSCC(CO)O)O |
| InChIKey | RFEMNKMKESLWMT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-((2-Hydroxyethyl)thio)-1,2-propanediol (CAS 1468-40-2), with molecular formula C5H12O3S and molecular weight 152.05 g/mol. IUPAC: 3-(2-hydroxyethylsulfanyl)propane-1,2-diol.
Chemical Property Profile of 3-((2-Hydroxyethyl)thio)-1,2-propanediol
Property Insights of 3-((2-Hydroxyethyl)thio)-1,2-propanediol
The XLogP value of -1.1 indicates that 3-((2-Hydroxyethyl)thio)-1,2-propanediol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((2-Hydroxyethyl)thio)-1,2-propanediol. Following Lipinski's Rule of Five, 3-((2-Hydroxyethyl)thio)-1,2-propanediol has 3 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 3-((2-Hydroxyethyl)thio)-1,2-propanediol?
The CAS number of 3-((2-Hydroxyethyl)thio)-1,2-propanediol is 1468-40-2.
What is the molecular formula of 3-((2-Hydroxyethyl)thio)-1,2-propanediol?
The molecular formula of 3-((2-Hydroxyethyl)thio)-1,2-propanediol is C5H12O3S.
What is the molecular weight of 3-((2-Hydroxyethyl)thio)-1,2-propanediol?
The molecular weight of 3-((2-Hydroxyethyl)thio)-1,2-propanediol is 152.05 g/mol.
Where can I buy 3-((2-Hydroxyethyl)thio)-1,2-propanediol?
You can request a quote for 3-((2-Hydroxyethyl)thio)-1,2-propanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((2-Hydroxyethyl)thio)-1,2-propanediol?
Yes, KEHONG BIO provides custom synthesis services for 3-((2-Hydroxyethyl)thio)-1,2-propanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.