4-Methylthiobutane-1,2-diol
TL;DR: 4-Methylthiobutane-1,2-diol (CAS 6362-71-6) is a chemical compound with molecular formula C5H12O2S and molecular weight 136.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylsulfanylbutane-1,2-diol
Also Known As: 1,2-Butanediol, 4-(methylthio)-, 4-Methylthiobutane-1,2-diol, 4-(methylthio)butane-1,2-diol, 4-methylsulfanylbutane-1,2-diol, 4-Methylthiobutan-1,2-diol
| Molecular Formula | C5H12O2S |
|---|---|
| Molecular Weight | 136.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 136.0558 |
| Heavy Atoms | 8 |
| Complexity | 49.0 |
Chemical Identifiers
| CAS Number | 6362-71-6 |
|---|---|
| SMILES | CSCCC(CO)O |
| InChIKey | MDBSFZVXGRMTLI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methylthiobutane-1,2-diol (CAS 6362-71-6), with molecular formula C5H12O2S and molecular weight 136.06 g/mol. IUPAC: 4-methylsulfanylbutane-1,2-diol.
Chemical Property Profile of 4-Methylthiobutane-1,2-diol
Property Insights of 4-Methylthiobutane-1,2-diol
The XLogP value of -0.1 indicates that 4-Methylthiobutane-1,2-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methylthiobutane-1,2-diol. Following Lipinski's Rule of Five, 4-Methylthiobutane-1,2-diol has 2 hydrogen bond donor(s) and 3 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 4-Methylthiobutane-1,2-diol?
The CAS number of 4-Methylthiobutane-1,2-diol is 6362-71-6.
What is the molecular formula of 4-Methylthiobutane-1,2-diol?
The molecular formula of 4-Methylthiobutane-1,2-diol is C5H12O2S.
What is the molecular weight of 4-Methylthiobutane-1,2-diol?
The molecular weight of 4-Methylthiobutane-1,2-diol is 136.06 g/mol.
Where can I buy 4-Methylthiobutane-1,2-diol?
You can request a quote for 4-Methylthiobutane-1,2-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylthiobutane-1,2-diol?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylthiobutane-1,2-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.