2,5-Dimethylphenyl 4-ethoxybenzenesulfonate
TL;DR: 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate (CAS 693232-00-7) is a chemical compound with molecular formula C16H18O4S and molecular weight 306.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dimethylphenyl) 4-ethoxybenzenesulfonate
Also Known As: 2,5-dimethylphenyl 4-ethoxybenzenesulfonate, (2,5-dimethylphenyl) 4-ethoxybenzenesulfonate, AP-263/41670552
| Molecular Formula | C16H18O4S |
|---|---|
| Molecular Weight | 306.09 g/mol |
| LogP | 3.46984 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.0926 |
| Heavy Atoms | 21 |
| Complexity | 718.44226 |
Chemical Identifiers
| CAS Number | 693232-00-7 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)C)C |
Product Overview
2,5-Dimethylphenyl 4-ethoxybenzenesulfonate (CAS 693232-00-7), with molecular formula C16H18O4S and molecular weight 306.09 g/mol. IUPAC: (2,5-dimethylphenyl) 4-ethoxybenzenesulfonate.
Chemical Property Profile of 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate
Property Insights of 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate
The XLogP value of 3.46984 indicates that 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate 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 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate?
The CAS number of 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate is 693232-00-7.
What is the molecular formula of 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate?
The molecular formula of 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate is C16H18O4S.
What is the molecular weight of 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate?
The molecular weight of 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate is 306.09 g/mol.
Where can I buy 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate?
You can request a quote for 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethylphenyl 4-ethoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.