Methanesulfonic acid, thio-, S-hexadecyl ester
TL;DR: Methanesulfonic acid, thio-, S-hexadecyl ester (CAS 7559-47-9) is a chemical compound with molecular formula C17H36O2S2 and molecular weight 336.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylsulfonylsulfanylhexadecane
Also Known As: S-Hexadecyl methanethiosulfonate, HEXADECYL METHANETHIOSULFONATE, 1-methylsulfonylsulfanylhexadecane, S-Hexadecyl methanesulfonothioate, HexadecylMethanethiosulfonate
| Molecular Formula | C17H36O2S2 |
|---|---|
| Molecular Weight | 336.22 g/mol |
| LogP | 7.8 |
| Topological Polar Surface Area | 67.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 16 |
| Exact Mass | 336.21567 |
| Heavy Atoms | 21 |
| Complexity | 294.0 |
Chemical Identifiers
| CAS Number | 7559-47-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCSS(=O)(=O)C |
| InChIKey | GIJWOCGDZZKJAD-UHFFFAOYSA-N |
Product Overview
Methanesulfonic acid, thio-, S-hexadecyl ester (CAS 7559-47-9), with molecular formula C17H36O2S2 and molecular weight 336.22 g/mol. IUPAC: 1-methylsulfonylsulfanylhexadecane.
Chemical Property Profile of Methanesulfonic acid, thio-, S-hexadecyl ester
Property Insights of Methanesulfonic acid, thio-, S-hexadecyl ester
The XLogP value of 7.8 indicates that Methanesulfonic acid, thio-, S-hexadecyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methanesulfonic acid, thio-, S-hexadecyl ester. Following Lipinski's Rule of Five, Methanesulfonic acid, thio-, S-hexadecyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methanesulfonic acid, thio-, S-hexadecyl ester?
The CAS number of Methanesulfonic acid, thio-, S-hexadecyl ester is 7559-47-9.
What is the molecular formula of Methanesulfonic acid, thio-, S-hexadecyl ester?
The molecular formula of Methanesulfonic acid, thio-, S-hexadecyl ester is C17H36O2S2.
What is the molecular weight of Methanesulfonic acid, thio-, S-hexadecyl ester?
The molecular weight of Methanesulfonic acid, thio-, S-hexadecyl ester is 336.22 g/mol.
Where can I buy Methanesulfonic acid, thio-, S-hexadecyl ester?
You can request a quote for Methanesulfonic acid, thio-, S-hexadecyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanesulfonic acid, thio-, S-hexadecyl ester?
Yes, KEHONG BIO provides custom synthesis services for Methanesulfonic acid, thio-, S-hexadecyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.