1-(3-Ethyloxiran-2-yl)ethan-1-one
TL;DR: 1-(3-Ethyloxiran-2-yl)ethan-1-one (CAS 17257-81-7) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-ethyloxiran-2-yl)ethanone
Also Known As: 3,4-EPOXY-2-HEXANONE, 1-(3-ethyloxiran-2-yl)ethanone, 2-Hexanone, 3,4-epoxy-, 3,4-Epoxy-hexan-2-on, 1-(3-ethyl-oxiranyl)-ethanone
Technical Specifications
| Molecular Formula | C6H10O2 |
| Molecular Weight | 114.06808 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 114.06808 Da |
| Heavy Atoms | 8 |
| Complexity | 109.0 |
| SMILES | CCC1C(O1)C(=O)C |
| InChIKey | MXXCXQDATRPYND-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3-Ethyloxiran-2-yl)ethan-1-one
Property Insights of 1-(3-Ethyloxiran-2-yl)ethan-1-one
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Ethyloxiran-2-yl)ethan-1-one. With a topological polar surface area (TPSA) of 29.6 Ų, 1-(3-Ethyloxiran-2-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Ethyloxiran-2-yl)ethan-1-one 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
What is the CAS number of 1-(3-Ethyloxiran-2-yl)ethan-1-one?
The CAS number of 1-(3-Ethyloxiran-2-yl)ethan-1-one is 17257-81-7.
What is the molecular formula of 1-(3-Ethyloxiran-2-yl)ethan-1-one?
The molecular formula of 1-(3-Ethyloxiran-2-yl)ethan-1-one is C6H10O2.
What is the molecular weight of 1-(3-Ethyloxiran-2-yl)ethan-1-one?
The molecular weight of 1-(3-Ethyloxiran-2-yl)ethan-1-one is 114.06808 g/mol.
Where can I buy 1-(3-Ethyloxiran-2-yl)ethan-1-one?
You can request a quote for 1-(3-Ethyloxiran-2-yl)ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3-Ethyloxiran-2-yl)ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(3-Ethyloxiran-2-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.