Sodium (5-Sulfonatopentyl)methanethiosulfonate
TL;DR: Sodium (5-Sulfonatopentyl)methanethiosulfonate (CAS 385398-80-1) is a chemical compound with molecular formula C6H13NaO5S3 and molecular weight 283.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
sodium 5-methylsulfonylsulfanylpentane-1-sulfonate
Also Known As: MTSPES, Sodium (5-Sulfonatopentyl)methanethiosulfonate, Sodium (5-Sulfonatopentyl) Methanethiosulfonate, sodium;5-methylsulfonylsulfanylpentane-1-sulfonate, Sodium 5-methylsulfonylsulfanylpentane-1-sulfonate
| Molecular Formula | C6H13NaO5S3 |
|---|---|
| Molecular Weight | 283.98 g/mol |
| LogP | -2.6013 |
| Topological Polar Surface Area | 91.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 283.98227 |
| Heavy Atoms | 15 |
| Complexity | 310.96365 |
Chemical Identifiers
| CAS Number | 385398-80-1 |
|---|---|
| SMILES | CS(=O)(=O)SCCCCCS(=O)(=O)[O-].[Na+] |
Product Overview
Sodium (5-Sulfonatopentyl)methanethiosulfonate (CAS 385398-80-1), with molecular formula C6H13NaO5S3 and molecular weight 283.98 g/mol. IUPAC: sodium 5-methylsulfonylsulfanylpentane-1-sulfonate.
Chemical Property Profile of Sodium (5-Sulfonatopentyl)methanethiosulfonate
Property Insights of Sodium (5-Sulfonatopentyl)methanethiosulfonate
The XLogP value of -2.6013 indicates that Sodium (5-Sulfonatopentyl)methanethiosulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 91.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Sodium (5-Sulfonatopentyl)methanethiosulfonate. Following Lipinski's Rule of Five, Sodium (5-Sulfonatopentyl)methanethiosulfonate has 0 hydrogen bond donor(s) and 6 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 Sodium (5-Sulfonatopentyl)methanethiosulfonate?
The CAS number of Sodium (5-Sulfonatopentyl)methanethiosulfonate is 385398-80-1.
What is the molecular formula of Sodium (5-Sulfonatopentyl)methanethiosulfonate?
The molecular formula of Sodium (5-Sulfonatopentyl)methanethiosulfonate is C6H13NaO5S3.
What is the molecular weight of Sodium (5-Sulfonatopentyl)methanethiosulfonate?
The molecular weight of Sodium (5-Sulfonatopentyl)methanethiosulfonate is 283.98 g/mol.
Where can I buy Sodium (5-Sulfonatopentyl)methanethiosulfonate?
You can request a quote for Sodium (5-Sulfonatopentyl)methanethiosulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sodium (5-Sulfonatopentyl)methanethiosulfonate?
Yes, KEHONG BIO provides custom synthesis services for Sodium (5-Sulfonatopentyl)methanethiosulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.