4-Ethyl-3,5-heptanedione dioxime
TL;DR: 4-Ethyl-3,5-heptanedione dioxime (CAS 63834-27-5) is a chemical compound with molecular formula C9H18N2O2 and molecular weight 186.13683 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-ethyl-5-hydroxyiminoheptan-3-ylidene)hydroxylamine
Also Known As: 4-Ethyl-3,5-heptanedione dioxime, (NE)-N-[(5E)-4-ethyl-5-hydroxyiminoheptan-3-ylidene]hydroxylamine
Technical Specifications
| Molecular Formula | C9H18N2O2 |
| Molecular Weight | 186.13683 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 65.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 186.13683 Da |
| Heavy Atoms | 13 |
| Complexity | 180.0 |
| SMILES | CCC(C(=NO)CC)C(=NO)CC |
| InChIKey | PDXXYPZTPKWGIJ-UHFFFAOYSA-N |
Chemical Property Profile of 4-Ethyl-3,5-heptanedione dioxime
Property Insights of 4-Ethyl-3,5-heptanedione dioxime
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Ethyl-3,5-heptanedione dioxime. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Ethyl-3,5-heptanedione dioxime. Following Lipinski's Rule of Five, 4-Ethyl-3,5-heptanedione dioxime has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Ethyl-3,5-heptanedione dioxime?
The CAS number of 4-Ethyl-3,5-heptanedione dioxime is 63834-27-5.
What is the molecular formula of 4-Ethyl-3,5-heptanedione dioxime?
The molecular formula of 4-Ethyl-3,5-heptanedione dioxime is C9H18N2O2.
What is the molecular weight of 4-Ethyl-3,5-heptanedione dioxime?
The molecular weight of 4-Ethyl-3,5-heptanedione dioxime is 186.13683 g/mol.
Where can I buy 4-Ethyl-3,5-heptanedione dioxime?
You can request a quote for 4-Ethyl-3,5-heptanedione dioxime directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Ethyl-3,5-heptanedione dioxime?
Yes, CoreyChem provides custom synthesis services for 4-Ethyl-3,5-heptanedione dioxime and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.