1-(3,5-Diethoxyphenyl)ethanone
TL;DR: 1-(3,5-Diethoxyphenyl)ethanone (CAS 103604-53-1) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,5-diethoxyphenyl)ethanone
Also Known As: 1-(3,5-diethoxyphenyl)ethanone, 3',5'-Diethoxyacetophenone, 3,5-Diethoxyacetophenone, 1-(3,5-diethoxyphenyl)ethan-1-one, 3' 5'-DIETHOXYACETOPHENONE 99
Technical Specifications
| Molecular Formula | C12H16O3 |
| Molecular Weight | 208.10994 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.10994 Da |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
| SMILES | CCOC1=CC(=CC(=C1)C(=O)C)OCC |
| InChIKey | KEJDYKMTNWEIAR-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3,5-Diethoxyphenyl)ethanone
Property Insights of 1-(3,5-Diethoxyphenyl)ethanone
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3,5-Diethoxyphenyl)ethanone. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(3,5-Diethoxyphenyl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,5-Diethoxyphenyl)ethanone 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
What is the CAS number of 1-(3,5-Diethoxyphenyl)ethanone?
The CAS number of 1-(3,5-Diethoxyphenyl)ethanone is 103604-53-1.
What is the molecular formula of 1-(3,5-Diethoxyphenyl)ethanone?
The molecular formula of 1-(3,5-Diethoxyphenyl)ethanone is C12H16O3.
What is the molecular weight of 1-(3,5-Diethoxyphenyl)ethanone?
The molecular weight of 1-(3,5-Diethoxyphenyl)ethanone is 208.10994 g/mol.
Where can I buy 1-(3,5-Diethoxyphenyl)ethanone?
You can request a quote for 1-(3,5-Diethoxyphenyl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3,5-Diethoxyphenyl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(3,5-Diethoxyphenyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.