2,2-Diethyloxirane
TL;DR: 2,2-Diethyloxirane (CAS 1192-17-2) is a chemical compound with molecular formula C6H12O and molecular weight 100.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-diethyloxirane
Also Known As: 2,2-diethyloxirane, Oxirane, 2,2-diethyl-, Oxirane,2-diethyl, Oxirane,2-diethyl-, 2, 2-Diethyloxirane
| Molecular Formula | C6H12O |
|---|---|
| Molecular Weight | 100.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 100.08881 |
| Heavy Atoms | 7 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 1192-17-2 |
|---|---|
| SMILES | CCC1(CO1)CC |
| InChIKey | OVKYVUFYOFPYNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Diethyloxirane (CAS 1192-17-2), with molecular formula C6H12O and molecular weight 100.09 g/mol. IUPAC: 2,2-diethyloxirane.
Chemical Property Profile of 2,2-Diethyloxirane
Property Insights of 2,2-Diethyloxirane
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Diethyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, 2,2-Diethyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Diethyloxirane 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 2,2-Diethyloxirane?
The CAS number of 2,2-Diethyloxirane is 1192-17-2.
What is the molecular formula of 2,2-Diethyloxirane?
The molecular formula of 2,2-Diethyloxirane is C6H12O.
What is the molecular weight of 2,2-Diethyloxirane?
The molecular weight of 2,2-Diethyloxirane is 100.09 g/mol.
Where can I buy 2,2-Diethyloxirane?
You can request a quote for 2,2-Diethyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Diethyloxirane?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Diethyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.