Thietane oxide
TL;DR: Thietane oxide (CAS 13153-11-2) is a chemical compound with molecular formula C3H6OS and molecular weight 90.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
thietane 1-oxide
Also Known As: Thietane 1-oxide, Thietane, 1-oxide, Thietane oxide, Thietane S-oxide, Propanesulfone
| Molecular Formula | C3H6OS |
|---|---|
| Molecular Weight | 90.01 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 90.01394 |
| Heavy Atoms | 5 |
| Complexity | 53.0 |
Chemical Identifiers
| CAS Number | 13153-11-2 |
|---|---|
| SMILES | C1CS(=O)C1 |
| InChIKey | GINSRDSEEGBTJO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thietane oxide (CAS 13153-11-2), with molecular formula C3H6OS and molecular weight 90.01 g/mol. IUPAC: thietane 1-oxide.
Chemical Property Profile of Thietane oxide
Property Insights of Thietane oxide
The XLogP value of -0.6 indicates that Thietane oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.3 Ų, Thietane oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thietane oxide 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 Thietane oxide?
The CAS number of Thietane oxide is 13153-11-2.
What is the molecular formula of Thietane oxide?
The molecular formula of Thietane oxide is C3H6OS.
What is the molecular weight of Thietane oxide?
The molecular weight of Thietane oxide is 90.01 g/mol.
Where can I buy Thietane oxide?
You can request a quote for Thietane oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thietane oxide?
Yes, KEHONG BIO provides custom synthesis services for Thietane oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.