4-甲氧基苯甲硫醚
TL;DR: 4-甲氧基苯甲硫醚 (CAS 1879-16-9) is a chemical compound with molecular formula C8H10OS and molecular weight 154.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲氧基苯甲硫醚
1-methoxy-4-methylsulfanylbenzene
Also Known As: 4-Methoxythioanisole, 1-Methoxy-4-(methylthio)benzene, 4-(Methylthio)anisole, Benzene, 1-methoxy-4-(methylthio)-, Isofraxidin
| Molecular Formula | C8H10OS |
|---|---|
| Molecular Weight | 154.05 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.04524 |
| Heavy Atoms | 10 |
| Complexity | 87.0 |
Chemical Identifiers
| CAS Number | 1879-16-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)SC |
| InChIKey | DQNSKXYRRRCKGH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-甲氧基苯甲硫醚 (CAS 1879-16-9), with molecular formula C8H10OS and molecular weight 154.05 g/mol. IUPAC: 1-methoxy-4-methylsulfanylbenzene.
Chemical Property Profile of 4-甲氧基苯甲硫醚
Property Insights of 4-甲氧基苯甲硫醚
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-甲氧基苯甲硫醚. With a topological polar surface area (TPSA) of 34.5 Ų, 4-甲氧基苯甲硫醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-甲氧基苯甲硫醚 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 4-甲氧基苯甲硫醚?
The CAS number of 4-甲氧基苯甲硫醚 is 1879-16-9.
What is the molecular formula of 4-甲氧基苯甲硫醚?
The molecular formula of 4-甲氧基苯甲硫醚 is C8H10OS.
What is the molecular weight of 4-甲氧基苯甲硫醚?
The molecular weight of 4-甲氧基苯甲硫醚 is 154.05 g/mol.
Where can I buy 4-甲氧基苯甲硫醚?
You can request a quote for 4-甲氧基苯甲硫醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲氧基苯甲硫醚?
Yes, KEHONG BIO provides custom synthesis services for 4-甲氧基苯甲硫醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.