5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene
TL;DR: 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene (CAS 166537-19-5) is a chemical compound with molecular formula C11H16OS and molecular weight 196.0922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene
Also Known As: (5-methoxy-2,3-dimethylbenzyl)(methyl)sulfane, 5-methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene
Technical Specifications
| Molecular Formula | C11H16OS |
| Molecular Weight | 196.0922 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.0922 Da |
| Heavy Atoms | 13 |
| Complexity | 149.0 |
| SMILES | CC1=CC(=CC(=C1C)CSC)OC |
| InChIKey | PFLILXDQLKREHD-UHFFFAOYSA-N |
Chemical Property Profile of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene
Property Insights of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene
The XLogP value of 3.1 indicates that 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)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, 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)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
What is the CAS number of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene?
The CAS number of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene is 166537-19-5.
What is the molecular formula of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene?
The molecular formula of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene is C11H16OS.
What is the molecular weight of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene?
The molecular weight of 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene is 196.0922 g/mol.
Where can I buy 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene?
You can request a quote for 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene?
Yes, CoreyChem provides custom synthesis services for 5-Methoxy-1,2-dimethyl-3-(methylsulfanylmethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.