3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate
TL;DR: 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate (CAS 723256-63-1) is a chemical compound with molecular formula C17H20O5S and molecular weight 336.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-tert-butyl-4-hydroxyphenyl) 4-methoxybenzenesulfonate
Also Known As: 3-tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate, (3-tert-butyl-4-hydroxyphenyl) 4-methoxybenzenesulfonate, AN-652/42476712
| Molecular Formula | C17H20O5S |
|---|---|
| Molecular Weight | 336.10 g/mol |
| LogP | 3.466 |
| Topological Polar Surface Area | 72.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.10315 |
| Heavy Atoms | 23 |
| Complexity | 786.7237 |
Chemical Identifiers
| CAS Number | 723256-63-1 |
|---|---|
| SMILES | CC(C)(C)C1=C(C=CC(=C1)OS(=O)(=O)C2=CC=C(C=C2)OC)O |
Product Overview
3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate (CAS 723256-63-1), with molecular formula C17H20O5S and molecular weight 336.10 g/mol. IUPAC: (3-tert-butyl-4-hydroxyphenyl) 4-methoxybenzenesulfonate.
Chemical Property Profile of 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate
Property Insights of 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate
The XLogP value of 3.466 indicates that 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate. Following Lipinski's Rule of Five, 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate has 1 hydrogen bond donor(s) and 5 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-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate?
The CAS number of 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate is 723256-63-1.
What is the molecular formula of 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate?
The molecular formula of 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate is C17H20O5S.
What is the molecular weight of 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate?
The molecular weight of 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate is 336.10 g/mol.
Where can I buy 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate?
You can request a quote for 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 3-Tert-butyl-4-hydroxyphenyl4-methoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.