![{2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol structure](/static/products/5466/5466-35-3.webp)
{2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol
TL;DR: {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol (CAS 5466-35-3) is a chemical compound with molecular formula C14H20O2S and molecular weight 252.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methyl-2-(4-propan-2-ylphenyl)-1,3-oxathiolan-5-yl]methanol
Also Known As: KST-1B5393, {2-methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol, 2-p-Cumenyl-2-methyl-1,3-oxathiolane-5-methanol, 1,3-Oxathiolane-5-methanol, 2-p-cumenyl-2-methyl-, 5-19-02-00586 (Beilstein Handbook Reference)
| Molecular Formula | C14H20O2S |
|---|---|
| Molecular Weight | 252.12 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 252.11841 |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 5466-35-3 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2(OC(CS2)CO)C |
| InChIKey | YPNQWMFQELDTOP-UHFFFAOYSA-N |
Product Overview
{2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol (CAS 5466-35-3), with molecular formula C14H20O2S and molecular weight 252.12 g/mol. IUPAC: [2-methyl-2-(4-propan-2-ylphenyl)-1,3-oxathiolan-5-yl]methanol.
Chemical Property Profile of {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol
Property Insights of {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol. With a topological polar surface area (TPSA) of 54.8 Ų, {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol has 1 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-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol?
The CAS number of {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol is 5466-35-3.
What is the molecular formula of {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol?
The molecular formula of {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol is C14H20O2S.
What is the molecular weight of {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol?
The molecular weight of {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol is 252.12 g/mol.
Where can I buy {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol?
You can request a quote for {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol?
Yes, KEHONG BIO provides custom synthesis services for {2-Methyl-2-[4-(propan-2-yl)phenyl]-1,3-oxathiolan-5-yl}methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.