2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide
TL;DR: 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide (CAS 64803-75-4) is a chemical compound with molecular formula C13H26O2S and molecular weight 246.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-octylthiane 1,1-dioxide
Also Known As: 4-octylthiane 1,1-dioxide, 4-Octyltetrahydro-2H-thiopyran 1,1-dioxide, 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide, 4-Octyl-1lambda~6~-thiane-1,1-dione, RefChem:269281
| Molecular Formula | C13H26O2S |
|---|---|
| Molecular Weight | 246.17 g/mol |
| LogP | 3.5618 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 246.16534 |
| Heavy Atoms | 16 |
| Complexity | 255.65718 |
Chemical Identifiers
| CAS Number | 64803-75-4 |
|---|---|
| SMILES | CCCCCCCCC1CCS(=O)(=O)CC1 |
Product Overview
2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide (CAS 64803-75-4), with molecular formula C13H26O2S and molecular weight 246.17 g/mol. IUPAC: 4-octylthiane 1,1-dioxide.
Chemical Property Profile of 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide
Property Insights of 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide
The XLogP value of 3.5618 indicates that 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.14 Ų, 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide 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 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide?
The CAS number of 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide is 64803-75-4.
What is the molecular formula of 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide?
The molecular formula of 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide is C13H26O2S.
What is the molecular weight of 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide?
The molecular weight of 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide is 246.17 g/mol.
Where can I buy 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide?
You can request a quote for 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 2H-Thiopyran, tetrahydro-4-octyl-, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.