2-(4-甲氧基苯基)-1,3-二硫戊环
TL;DR: 2-(4-甲氧基苯基)-1,3-二硫戊环 (CAS 6712-20-5) is a chemical compound with molecular formula C10H12OS2 and molecular weight 212.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-甲氧基苯基)-1,3-二硫戊环
2-(4-methoxyphenyl)-1,3-dithiolane
Also Known As: 2-(4-Methoxyphenyl)-1,3-dithiolane, 4-Methoxyphenyl-1,3-dithiolane, 2-(p-Methoxyphenyl)-1,3-dithiolane, Para-methoxyphenyl-1,3-dithiolane, 1,3-Dithiolane, 2-(4-methoxyphenyl)-
| Molecular Formula | C10H12OS2 |
|---|---|
| Molecular Weight | 212.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.03296 |
| Heavy Atoms | 13 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 6712-20-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2SCCS2 |
| InChIKey | JYWZOJISGOBZDP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-甲氧基苯基)-1,3-二硫戊环 (CAS 6712-20-5), with molecular formula C10H12OS2 and molecular weight 212.03 g/mol. IUPAC: 2-(4-methoxyphenyl)-1,3-dithiolane.
Chemical Property Profile of 2-(4-甲氧基苯基)-1,3-二硫戊环
Property Insights of 2-(4-甲氧基苯基)-1,3-二硫戊环
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-甲氧基苯基)-1,3-二硫戊环. With a topological polar surface area (TPSA) of 59.8 Ų, 2-(4-甲氧基苯基)-1,3-二硫戊环 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-甲氧基苯基)-1,3-二硫戊环 has 0 hydrogen bond donor(s) and 3 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-(4-甲氧基苯基)-1,3-二硫戊环?
The CAS number of 2-(4-甲氧基苯基)-1,3-二硫戊环 is 6712-20-5.
What is the molecular formula of 2-(4-甲氧基苯基)-1,3-二硫戊环?
The molecular formula of 2-(4-甲氧基苯基)-1,3-二硫戊环 is C10H12OS2.
What is the molecular weight of 2-(4-甲氧基苯基)-1,3-二硫戊环?
The molecular weight of 2-(4-甲氧基苯基)-1,3-二硫戊环 is 212.03 g/mol.
Where can I buy 2-(4-甲氧基苯基)-1,3-二硫戊环?
You can request a quote for 2-(4-甲氧基苯基)-1,3-二硫戊环 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-甲氧基苯基)-1,3-二硫戊环?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-甲氧基苯基)-1,3-二硫戊环 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.