Dimethylaminoethylthiosulfuric acid
TL;DR: Dimethylaminoethylthiosulfuric acid (CAS 14013-30-0) is a chemical compound with molecular formula C4H11NO3S2 and molecular weight 185.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(dimethylamino)-2-sulfosulfanylethane
Also Known As: Dimethylaminoethanethiol S-sulfate, Epitope ID:167836, NCIStruc1_000259, NCIStruc2_000058, S-2-(dimethylamino)ethyl thiosulfate
| Molecular Formula | C4H11NO3S2 |
|---|---|
| Molecular Weight | 185.02 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 91.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 185.01804 |
| Heavy Atoms | 10 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 14013-30-0 |
|---|---|
| SMILES | CN(C)CCSS(=O)(=O)O |
| InChIKey | RRJZGRCYRQRMEO-UHFFFAOYSA-N |
Product Overview
Dimethylaminoethylthiosulfuric acid (CAS 14013-30-0), with molecular formula C4H11NO3S2 and molecular weight 185.02 g/mol. IUPAC: 1-(dimethylamino)-2-sulfosulfanylethane.
Chemical Property Profile of Dimethylaminoethylthiosulfuric acid
Property Insights of Dimethylaminoethylthiosulfuric acid
The XLogP value of -2.7 indicates that Dimethylaminoethylthiosulfuric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethylaminoethylthiosulfuric acid. Following Lipinski's Rule of Five, Dimethylaminoethylthiosulfuric acid 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 Dimethylaminoethylthiosulfuric acid?
The CAS number of Dimethylaminoethylthiosulfuric acid is 14013-30-0.
What is the molecular formula of Dimethylaminoethylthiosulfuric acid?
The molecular formula of Dimethylaminoethylthiosulfuric acid is C4H11NO3S2.
What is the molecular weight of Dimethylaminoethylthiosulfuric acid?
The molecular weight of Dimethylaminoethylthiosulfuric acid is 185.02 g/mol.
Where can I buy Dimethylaminoethylthiosulfuric acid?
You can request a quote for Dimethylaminoethylthiosulfuric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethylaminoethylthiosulfuric acid?
Yes, KEHONG BIO provides custom synthesis services for Dimethylaminoethylthiosulfuric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.