2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide
TL;DR: 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide (CAS 64803-74-3) is a chemical compound with molecular formula C13H26OS and molecular weight 230.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-octylthiane 1-oxide
Also Known As: 4-octylthiane 1-oxide, 4-Octyltetrahydro-2H-thiopyran 1-oxide, 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide, 4-Octyl-1lambda~4~-thian-1-one, RefChem:269282
| Molecular Formula | C13H26OS |
|---|---|
| Molecular Weight | 230.17 g/mol |
| LogP | 3.8957 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 230.17044 |
| Heavy Atoms | 15 |
| Complexity | 169.37477 |
Chemical Identifiers
| CAS Number | 64803-74-3 |
|---|---|
| SMILES | CCCCCCCCC1CCS(=O)CC1 |
Product Overview
2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide (CAS 64803-74-3), with molecular formula C13H26OS and molecular weight 230.17 g/mol. IUPAC: 4-octylthiane 1-oxide.
Chemical Property Profile of 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide
Property Insights of 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide
The XLogP value of 3.8957 indicates that 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide has 0 hydrogen bond donor(s) and 1 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-oxide?
The CAS number of 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide is 64803-74-3.
What is the molecular formula of 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide?
The molecular formula of 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide is C13H26OS.
What is the molecular weight of 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide?
The molecular weight of 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide is 230.17 g/mol.
Where can I buy 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide?
You can request a quote for 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide 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-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2H-Thiopyran, tetrahydro-4-octyl-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.