Phenyl 4-methoxybenzenesulfonate
TL;DR: Phenyl 4-methoxybenzenesulfonate (CAS 62141-81-5) is a chemical compound with molecular formula C13H12O4S and molecular weight 264.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 4-methoxybenzenesulfonate
Also Known As: phenyl 4-methoxybenzenesulfonate, phenyl 4-methoxybenzene-1-sulfonate, BAS 02106391, 4-Methoxy-benzenesulfonic acid phenyl ester, BIM-0008069.P001
| Molecular Formula | C13H12O4S |
|---|---|
| Molecular Weight | 264.05 g/mol |
| LogP | 2.4629 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 264.04562 |
| Heavy Atoms | 18 |
| Complexity | 603.19934 |
Chemical Identifiers
| CAS Number | 62141-81-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC=C2 |
Product Overview
Phenyl 4-methoxybenzenesulfonate (CAS 62141-81-5), with molecular formula C13H12O4S and molecular weight 264.05 g/mol. IUPAC: phenyl 4-methoxybenzenesulfonate.
Chemical Property Profile of Phenyl 4-methoxybenzenesulfonate
Property Insights of Phenyl 4-methoxybenzenesulfonate
The XLogP value of 2.4629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl 4-methoxybenzenesulfonate. With a topological polar surface area (TPSA) of 52.6 Ų, Phenyl 4-methoxybenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 4-methoxybenzenesulfonate 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 Phenyl 4-methoxybenzenesulfonate?
The CAS number of Phenyl 4-methoxybenzenesulfonate is 62141-81-5.
What is the molecular formula of Phenyl 4-methoxybenzenesulfonate?
The molecular formula of Phenyl 4-methoxybenzenesulfonate is C13H12O4S.
What is the molecular weight of Phenyl 4-methoxybenzenesulfonate?
The molecular weight of Phenyl 4-methoxybenzenesulfonate is 264.05 g/mol.
Where can I buy Phenyl 4-methoxybenzenesulfonate?
You can request a quote for Phenyl 4-methoxybenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 4-methoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 4-methoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.