1-Methoxy-2-(phenylthio)benzene
TL;DR: 1-Methoxy-2-(phenylthio)benzene (CAS 14065-22-6) is a chemical compound with molecular formula C13H12OS and molecular weight 216.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-2-phenylsulfanylbenzene
Also Known As: 1-methoxy-2-(phenylthio)benzene, 2-Methoxydiphenyl sulfide, benzene, 1-methoxy-2-(phenylthio)-, 2-Methoxyphenylphenyl sulfide, 2-methoxyphenyl phenyl sulfide
| Molecular Formula | C13H12OS |
|---|---|
| Molecular Weight | 216.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 216.06088 |
| Heavy Atoms | 15 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 14065-22-6 |
|---|---|
| SMILES | COC1=CC=CC=C1SC2=CC=CC=C2 |
| InChIKey | PLMKPWXDMAOTPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methoxy-2-(phenylthio)benzene (CAS 14065-22-6), with molecular formula C13H12OS and molecular weight 216.06 g/mol. IUPAC: 1-methoxy-2-phenylsulfanylbenzene.
Chemical Property Profile of 1-Methoxy-2-(phenylthio)benzene
Property Insights of 1-Methoxy-2-(phenylthio)benzene
The XLogP value of 4.0 indicates that 1-Methoxy-2-(phenylthio)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.5 Ų, 1-Methoxy-2-(phenylthio)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxy-2-(phenylthio)benzene 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 1-Methoxy-2-(phenylthio)benzene?
The CAS number of 1-Methoxy-2-(phenylthio)benzene is 14065-22-6.
What is the molecular formula of 1-Methoxy-2-(phenylthio)benzene?
The molecular formula of 1-Methoxy-2-(phenylthio)benzene is C13H12OS.
What is the molecular weight of 1-Methoxy-2-(phenylthio)benzene?
The molecular weight of 1-Methoxy-2-(phenylthio)benzene is 216.06 g/mol.
Where can I buy 1-Methoxy-2-(phenylthio)benzene?
You can request a quote for 1-Methoxy-2-(phenylthio)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methoxy-2-(phenylthio)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxy-2-(phenylthio)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.