2-Isopropyl-6-methyl-1,3-oxathiane
TL;DR: 2-Isopropyl-6-methyl-1,3-oxathiane (CAS 33709-60-3) is a chemical compound with molecular formula C8H16OS and molecular weight 160.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-2-propan-2-yl-1,3-oxathiane
Also Known As: 2-Isopropyl-6-methyl-1,3-oxathiane, 1,3-Oxathiane, 2-isopropyl-6-methyl-, 6-methyl-2-(propan-2-yl)-1,3-oxathiane, 2-Isopropyl-6-methyl-1,3-oxathiane #, 6-methyl-2-propan-2-yl-1,3-oxathiane
| Molecular Formula | C8H16OS |
|---|---|
| Molecular Weight | 160.09 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 34.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 160.0922 |
| Heavy Atoms | 10 |
| Complexity | 103.0 |
Chemical Identifiers
| CAS Number | 33709-60-3 |
|---|---|
| SMILES | CC1CCSC(O1)C(C)C |
| InChIKey | SIJVEYDZJVMCFI-UHFFFAOYSA-N |
Product Overview
2-Isopropyl-6-methyl-1,3-oxathiane (CAS 33709-60-3), with molecular formula C8H16OS and molecular weight 160.09 g/mol. IUPAC: 6-methyl-2-propan-2-yl-1,3-oxathiane.
Chemical Property Profile of 2-Isopropyl-6-methyl-1,3-oxathiane
Property Insights of 2-Isopropyl-6-methyl-1,3-oxathiane
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Isopropyl-6-methyl-1,3-oxathiane. With a topological polar surface area (TPSA) of 34.5 Ų, 2-Isopropyl-6-methyl-1,3-oxathiane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropyl-6-methyl-1,3-oxathiane 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 2-Isopropyl-6-methyl-1,3-oxathiane?
The CAS number of 2-Isopropyl-6-methyl-1,3-oxathiane is 33709-60-3.
What is the molecular formula of 2-Isopropyl-6-methyl-1,3-oxathiane?
The molecular formula of 2-Isopropyl-6-methyl-1,3-oxathiane is C8H16OS.
What is the molecular weight of 2-Isopropyl-6-methyl-1,3-oxathiane?
The molecular weight of 2-Isopropyl-6-methyl-1,3-oxathiane is 160.09 g/mol.
Where can I buy 2-Isopropyl-6-methyl-1,3-oxathiane?
You can request a quote for 2-Isopropyl-6-methyl-1,3-oxathiane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Isopropyl-6-methyl-1,3-oxathiane?
Yes, KEHONG BIO provides custom synthesis services for 2-Isopropyl-6-methyl-1,3-oxathiane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.