5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline
TL;DR: 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline (CAS 58010-94-9) is a chemical compound with molecular formula C7H12N2O2 and molecular weight 156.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethyl-2-methyl-1,3,4-oxadiazol-3-yl)ethanone
Also Known As: 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline, 1-(2-ethyl-2-methyl-1,3,4-oxadiazol-3-yl)ethanone, 1,3,4-Oxadiazole,3-acetyl-2-ethyl-2,3-dihydro-2-methyl, 1,3,4-Oxadiazole, 3-acetyl-2-ethyl-2,3-dihydro-2-methyl-, 1-(2-Ethyl-2-methyl-1,3,4-oxadiazol-3(2H)-yl)ethan-1-one
| Molecular Formula | C7H12N2O2 |
|---|---|
| Molecular Weight | 156.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 156.08987 |
| Heavy Atoms | 11 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 58010-94-9 |
|---|---|
| SMILES | CCC1(N(N=CO1)C(=O)C)C |
| InChIKey | ZHCHSWANBCUERS-UHFFFAOYSA-N |
Product Overview
5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline (CAS 58010-94-9), with molecular formula C7H12N2O2 and molecular weight 156.09 g/mol. IUPAC: 1-(2-ethyl-2-methyl-1,3,4-oxadiazol-3-yl)ethanone.
Chemical Property Profile of 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline
Property Insights of 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline. With a topological polar surface area (TPSA) of 41.9 Ų, 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline 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 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline?
The CAS number of 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline is 58010-94-9.
What is the molecular formula of 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline?
The molecular formula of 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline is C7H12N2O2.
What is the molecular weight of 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline?
The molecular weight of 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline is 156.09 g/mol.
Where can I buy 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline?
You can request a quote for 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-5-methyl-4-acetyl-1,3,4-oxadiazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.