2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane
TL;DR: 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane (CAS 100058-73-9) is a chemical compound with molecular formula C11H14O2S and molecular weight 210.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)-2-methyl-1,3-oxathiolane
Also Known As: 2-(4-methoxyphenyl)-2-methyl-1,3-oxathiolane, 1,3-Oxathiolane, 2-(4-methoxyphenyl)-2-methyl-, Methyl 4-(2-methyl-1,3-oxathiolan-2-yl)phenyl ether #, RefChem:252515
| Molecular Formula | C11H14O2S |
|---|---|
| Molecular Weight | 210.07 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.07146 |
| Heavy Atoms | 14 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 100058-73-9 |
|---|---|
| SMILES | CC1(OCCS1)C2=CC=C(C=C2)OC |
| InChIKey | CPKMGVIZXNRMPD-UHFFFAOYSA-N |
Product Overview
2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane (CAS 100058-73-9), with molecular formula C11H14O2S and molecular weight 210.07 g/mol. IUPAC: 2-(4-methoxyphenyl)-2-methyl-1,3-oxathiolane.
Chemical Property Profile of 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane
Property Insights of 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane. With a topological polar surface area (TPSA) of 43.8 Ų, 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane 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-Methoxyphenyl)-2-methyl-1,3-oxathiolane?
The CAS number of 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane is 100058-73-9.
What is the molecular formula of 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane?
The molecular formula of 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane is C11H14O2S.
What is the molecular weight of 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane?
The molecular weight of 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane is 210.07 g/mol.
Where can I buy 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane?
You can request a quote for 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Methoxyphenyl)-2-methyl-1,3-oxathiolane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.