3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate
TL;DR: 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate (CAS 693232-75-6) is a chemical compound with molecular formula C17H20O4S and molecular weight 320.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5-dimethylphenyl) 4-methoxy-2,5-dimethylbenzenesulfonate
Also Known As: 3,5-dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate, (3,5-dimethylphenyl) 4-methoxy-2,5-dimethylbenzenesulfonate, 3,5-dimethylphenyl 4-methoxy-2,5-dimethylbenzene-1-sulfonate
| Molecular Formula | C17H20O4S |
|---|---|
| Molecular Weight | 320.11 g/mol |
| LogP | 3.69658 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 320.10822 |
| Heavy Atoms | 22 |
| Complexity | 787.3989 |
Chemical Identifiers
| CAS Number | 693232-75-6 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OS(=O)(=O)C2=CC(=C(C=C2C)OC)C)C |
Product Overview
3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate (CAS 693232-75-6), with molecular formula C17H20O4S and molecular weight 320.11 g/mol. IUPAC: (3,5-dimethylphenyl) 4-methoxy-2,5-dimethylbenzenesulfonate.
Chemical Property Profile of 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate
Property Insights of 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate
The XLogP value of 3.69658 indicates that 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate has 0 hydrogen bond donor(s) and 4 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 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate?
The CAS number of 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate is 693232-75-6.
What is the molecular formula of 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate?
The molecular formula of 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate is C17H20O4S.
What is the molecular weight of 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate?
The molecular weight of 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate is 320.11 g/mol.
Where can I buy 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate?
You can request a quote for 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dimethylphenyl 4-methoxy-2,5-dimethylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.