1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-
TL;DR: 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- (CAS 34005-00-0) is a chemical compound with molecular formula C6H12O4S3 and molecular weight 243.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxycarbothioylsulfanylpropane-1-sulfonic acid
Also Known As: 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-, 3-ethoxycarbothioylsulfanylpropane-1-sulfonic Acid, 3-((Ethoxycarbonothioyl)thio)propane-1-sulfonic acid, 1-Propanesulfonic acid, 3-[(ethoxythioxomethyl)thio]-, 3-[(Ethoxycarbonothioyl)sulfanyl]propane-1-sulfonic acid
| Molecular Formula | C6H12O4S3 |
|---|---|
| Molecular Weight | 243.99 g/mol |
| LogP | 1.3189 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.98978 |
| Heavy Atoms | 13 |
| Complexity | 246.60498 |
Chemical Identifiers
| CAS Number | 34005-00-0 |
|---|---|
| SMILES | CCOC(=S)SCCCS(=O)(=O)O |
Product Overview
1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- (CAS 34005-00-0), with molecular formula C6H12O4S3 and molecular weight 243.99 g/mol. IUPAC: 3-ethoxycarbothioylsulfanylpropane-1-sulfonic acid.
Chemical Property Profile of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-
Property Insights of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-
The XLogP value of 1.3189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-. Following Lipinski's Rule of Five, 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- has 1 hydrogen bond donor(s) and 5 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 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-?
The CAS number of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- is 34005-00-0.
What is the molecular formula of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-?
The molecular formula of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- is C6H12O4S3.
What is the molecular weight of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-?
The molecular weight of 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- is 243.99 g/mol.
Where can I buy 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-?
You can request a quote for 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Propanesulfonic acid, 3-((ethoxythioxomethyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.