3,3-Diethyloxetane
TL;DR: 3,3-Diethyloxetane (CAS 10196-39-1) is a chemical compound with molecular formula C7H14O and molecular weight 114.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-diethyloxetane
Also Known As: 3,3-Diethyloxetane, 3,3-diethyl oxetane, OXETANE, 3,3-DIETHYL-, Oxetane, 3,3-diethyl, 3,3-diethyl-oxetane
| Molecular Formula | C7H14O |
|---|---|
| Molecular Weight | 114.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 114.10446 |
| Heavy Atoms | 8 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 10196-39-1 |
|---|---|
| SMILES | CCC1(COC1)CC |
| InChIKey | VFYHHERJNPKXIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3-Diethyloxetane (CAS 10196-39-1), with molecular formula C7H14O and molecular weight 114.10 g/mol. IUPAC: 3,3-diethyloxetane.
Chemical Property Profile of 3,3-Diethyloxetane
Property Insights of 3,3-Diethyloxetane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Diethyloxetane. With a topological polar surface area (TPSA) of 9.2 Ų, 3,3-Diethyloxetane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Diethyloxetane 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 3,3-Diethyloxetane?
The CAS number of 3,3-Diethyloxetane is 10196-39-1.
What is the molecular formula of 3,3-Diethyloxetane?
The molecular formula of 3,3-Diethyloxetane is C7H14O.
What is the molecular weight of 3,3-Diethyloxetane?
The molecular weight of 3,3-Diethyloxetane is 114.10 g/mol.
Where can I buy 3,3-Diethyloxetane?
You can request a quote for 3,3-Diethyloxetane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Diethyloxetane?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Diethyloxetane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.