Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate
TL;DR: Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate (CAS 122533-49-7) is a chemical compound with molecular formula C23H40O6S2 and molecular weight 476.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-(4-tetradecanoyloxyphenyl)sulfanium;methyl sulfate
Also Known As: Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate, dimethyl-(4-tetradecanoyloxyphenyl)sulfanium; methyl sulfate, Dimethyl[4-(tetradecanoyloxy)phenyl]sulfanium methyl sulfate, dimethyl-(4-tetradecanoyloxyphenyl)sulfonium; methyl hydrogen sulfate, Sulfonium, dimethyl[4-[(1-oxotetradecyl)oxy]phenyl]-, methyl sulfate
| Molecular Formula | C23H40O6S2 |
|---|---|
| Molecular Weight | 476.23 g/mol |
| LogP | 5.6229 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 476.22662 |
| Heavy Atoms | 31 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 122533-49-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)[S+](C)C.COS(=O)(=O)[O-] |
| InChIKey | XFJJCQQGVOSGAA-UHFFFAOYSA-M |
Product Overview
Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate (CAS 122533-49-7), with molecular formula C23H40O6S2 and molecular weight 476.23 g/mol. IUPAC: dimethyl-(4-tetradecanoyloxyphenyl)sulfanium;methyl sulfate.
Chemical Property Profile of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate
Property Insights of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate
The XLogP value of 5.6229 indicates that Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate. Following Lipinski's Rule of Five, Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate?
The CAS number of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate is 122533-49-7.
What is the molecular formula of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate?
The molecular formula of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate is C23H40O6S2.
What is the molecular weight of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate?
The molecular weight of Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate is 476.23 g/mol.
Where can I buy Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate?
You can request a quote for Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate?
Yes, KEHONG BIO provides custom synthesis services for Sulfonium, dimethyl(4-((1-oxotetradecyl)oxy)phenyl)-, methyl sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.