Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide
TL;DR: Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide (CAS 87947-59-9) is a chemical compound with molecular formula C12H24O3S2 and molecular weight 280.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-octylsulfinylthiolane 1,1-dioxide
Also Known As: 3-octylsulfinylthiolane 1,1-dioxide, Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide, 3-(octylsulfinyl)tetrahydrothiophene 1,1-dioxide, 1,1-dioxidotetrahydrothiophen-3-yl octyl sulfoxide, 3-(Octane-1-sulfinyl)-1lambda~6~-thiolane-1,1-dione
| Molecular Formula | C12H24O3S2 |
|---|---|
| Molecular Weight | 280.12 g/mol |
| LogP | 2.2827 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 280.1167 |
| Heavy Atoms | 17 |
| Complexity | 335.6599 |
Chemical Identifiers
| CAS Number | 87947-59-9 |
|---|---|
| SMILES | CCCCCCCCS(=O)C1CCS(=O)(=O)C1 |
Product Overview
Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide (CAS 87947-59-9), with molecular formula C12H24O3S2 and molecular weight 280.12 g/mol. IUPAC: 3-octylsulfinylthiolane 1,1-dioxide.
Chemical Property Profile of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide
Property Insights of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide
The XLogP value of 2.2827 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide. With a topological polar surface area (TPSA) of 51.21 Ų, Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide 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 Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide?
The CAS number of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide is 87947-59-9.
What is the molecular formula of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide?
The molecular formula of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide is C12H24O3S2.
What is the molecular weight of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide?
The molecular weight of Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide is 280.12 g/mol.
Where can I buy Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide?
You can request a quote for Thiophene, tetrahydro-3-(octylsulfinyl)-, 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 Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for Thiophene, tetrahydro-3-(octylsulfinyl)-, 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.