p-Tolyl ethyl sulfoxide
TL;DR: p-Tolyl ethyl sulfoxide (CAS 6378-07-0) is a chemical compound with molecular formula C9H12OS and molecular weight 168.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylsulfinyl-4-methylbenzene
Also Known As: p-Tolyl ethyl sulfoxide, ethyl p-tolyl sulfoxide, ethyl-p-tolyl sulfoxide, 4-(Ethylsulfinyl)toluene, p-Tolyl(ethyl) sulfoxide
| Molecular Formula | C9H12OS |
|---|---|
| Molecular Weight | 168.06 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.06088 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 6378-07-0 |
|---|---|
| SMILES | CCS(=O)C1=CC=C(C=C1)C |
| InChIKey | OHXBXXWDEOXULA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Tolyl ethyl sulfoxide (CAS 6378-07-0), with molecular formula C9H12OS and molecular weight 168.06 g/mol. IUPAC: 1-ethylsulfinyl-4-methylbenzene.
Chemical Property Profile of p-Tolyl ethyl sulfoxide
Property Insights of p-Tolyl ethyl sulfoxide
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Tolyl ethyl sulfoxide. With a topological polar surface area (TPSA) of 36.3 Ų, p-Tolyl ethyl sulfoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Tolyl ethyl sulfoxide has 0 hydrogen bond donor(s) and 2 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 p-Tolyl ethyl sulfoxide?
The CAS number of p-Tolyl ethyl sulfoxide is 6378-07-0.
What is the molecular formula of p-Tolyl ethyl sulfoxide?
The molecular formula of p-Tolyl ethyl sulfoxide is C9H12OS.
What is the molecular weight of p-Tolyl ethyl sulfoxide?
The molecular weight of p-Tolyl ethyl sulfoxide is 168.06 g/mol.
Where can I buy p-Tolyl ethyl sulfoxide?
You can request a quote for p-Tolyl ethyl sulfoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Tolyl ethyl sulfoxide?
Yes, KEHONG BIO provides custom synthesis services for p-Tolyl ethyl sulfoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.