Mesityl 2,4,6-trimethylbenzenesulfonate
TL;DR: Mesityl 2,4,6-trimethylbenzenesulfonate (CAS 299968-84-6) is a chemical compound with molecular formula C18H22O3S and molecular weight 318.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4,6-trimethylphenyl) 2,4,6-trimethylbenzenesulfonate
Also Known As: mesityl 2,4,6-trimethylbenzenesulfonate, BAS 00064477, 2,4,6-trimethylphenyl 2,4,6-trimethylbenzene-1-sulfonate, mesityl(mesityloxy)(oxo)-lambda-sulfaniumolate, F0378-0057
| Molecular Formula | C18H22O3S |
|---|---|
| Molecular Weight | 318.13 g/mol |
| LogP | 4.30482 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.12897 |
| Heavy Atoms | 22 |
| Complexity | 787.3962 |
Chemical Identifiers
| CAS Number | 299968-84-6 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)OS(=O)(=O)C2=C(C=C(C=C2C)C)C)C |
Product Overview
Mesityl 2,4,6-trimethylbenzenesulfonate (CAS 299968-84-6), with molecular formula C18H22O3S and molecular weight 318.13 g/mol. IUPAC: (2,4,6-trimethylphenyl) 2,4,6-trimethylbenzenesulfonate.
Chemical Property Profile of Mesityl 2,4,6-trimethylbenzenesulfonate
Property Insights of Mesityl 2,4,6-trimethylbenzenesulfonate
The XLogP value of 4.30482 indicates that Mesityl 2,4,6-trimethylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, Mesityl 2,4,6-trimethylbenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Mesityl 2,4,6-trimethylbenzenesulfonate has 0 hydrogen bond donor(s) and 3 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 Mesityl 2,4,6-trimethylbenzenesulfonate?
The CAS number of Mesityl 2,4,6-trimethylbenzenesulfonate is 299968-84-6.
What is the molecular formula of Mesityl 2,4,6-trimethylbenzenesulfonate?
The molecular formula of Mesityl 2,4,6-trimethylbenzenesulfonate is C18H22O3S.
What is the molecular weight of Mesityl 2,4,6-trimethylbenzenesulfonate?
The molecular weight of Mesityl 2,4,6-trimethylbenzenesulfonate is 318.13 g/mol.
Where can I buy Mesityl 2,4,6-trimethylbenzenesulfonate?
You can request a quote for Mesityl 2,4,6-trimethylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mesityl 2,4,6-trimethylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Mesityl 2,4,6-trimethylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.