2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate
TL;DR: 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate (CAS 723256-74-4) 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.
(5-methyl-2-propan-2-ylphenyl) 4-methoxybenzenesulfonate
Also Known As: 2-isopropyl-5-methylphenyl4-methoxybenzenesulfonate, AN-652/42476743, (5-methyl-2-propan-2-ylphenyl) 4-methoxybenzenesulfonate
| Molecular Formula | C17H20O4S |
|---|---|
| Molecular Weight | 320.11 g/mol |
| LogP | 3.89472 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 320.10822 |
| Heavy Atoms | 22 |
| Complexity | 746.72845 |
Chemical Identifiers
| CAS Number | 723256-74-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C(C)C)OS(=O)(=O)C2=CC=C(C=C2)OC |
Product Overview
2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate (CAS 723256-74-4), with molecular formula C17H20O4S and molecular weight 320.11 g/mol. IUPAC: (5-methyl-2-propan-2-ylphenyl) 4-methoxybenzenesulfonate.
Chemical Property Profile of 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate
Property Insights of 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate
The XLogP value of 3.89472 indicates that 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate 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-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropyl-5-methylphenyl4-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 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate?
The CAS number of 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate is 723256-74-4.
What is the molecular formula of 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate?
The molecular formula of 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate is C17H20O4S.
What is the molecular weight of 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate?
The molecular weight of 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate is 320.11 g/mol.
Where can I buy 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate?
You can request a quote for 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-Isopropyl-5-methylphenyl4-methoxybenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.