1-Methoxy-4-(methoxysulfanyl)benzene
TL;DR: 1-Methoxy-4-(methoxysulfanyl)benzene (CAS 71902-32-4) is a chemical compound with molecular formula C8H10O2S and molecular weight 170.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-4-methoxysulfanylbenzene
Also Known As: 1-Methoxy-4-(methoxysulfanyl)benzene, 1-methoxy-4-methoxysulfanylbenzene, 4-MethoxybenzeneSulfenic acid methyl ester, RefChem:231330
| Molecular Formula | C8H10O2S |
|---|---|
| Molecular Weight | 170.04 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 170.04015 |
| Heavy Atoms | 11 |
| Complexity | 100.0 |
Chemical Identifiers
| CAS Number | 71902-32-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)SOC |
| InChIKey | IVEPAIAAVCOIAA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methoxy-4-(methoxysulfanyl)benzene (CAS 71902-32-4), with molecular formula C8H10O2S and molecular weight 170.04 g/mol. IUPAC: 1-methoxy-4-methoxysulfanylbenzene.
Chemical Property Profile of 1-Methoxy-4-(methoxysulfanyl)benzene
Property Insights of 1-Methoxy-4-(methoxysulfanyl)benzene
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methoxy-4-(methoxysulfanyl)benzene. With a topological polar surface area (TPSA) of 43.8 Ų, 1-Methoxy-4-(methoxysulfanyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methoxy-4-(methoxysulfanyl)benzene 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 1-Methoxy-4-(methoxysulfanyl)benzene?
The CAS number of 1-Methoxy-4-(methoxysulfanyl)benzene is 71902-32-4.
What is the molecular formula of 1-Methoxy-4-(methoxysulfanyl)benzene?
The molecular formula of 1-Methoxy-4-(methoxysulfanyl)benzene is C8H10O2S.
What is the molecular weight of 1-Methoxy-4-(methoxysulfanyl)benzene?
The molecular weight of 1-Methoxy-4-(methoxysulfanyl)benzene is 170.04 g/mol.
Where can I buy 1-Methoxy-4-(methoxysulfanyl)benzene?
You can request a quote for 1-Methoxy-4-(methoxysulfanyl)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-4-(methoxysulfanyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Methoxy-4-(methoxysulfanyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.