1-(3,4-Dipropoxyphenyl)ethan-1-one
TL;DR: 1-(3,4-Dipropoxyphenyl)ethan-1-one (CAS 105321-59-3) is a chemical compound with molecular formula C14H20O3 and molecular weight 236.14125 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dipropoxyphenyl)ethanone
Also Known As: 1-(3,4-dipropoxyphenyl)ethan-1-one, 1-(3,4-dipropoxyphenyl)ethanone, 1-(3,4-dipropoxyphenyl)-1-ethanone, 994-687-2, G33232
Technical Specifications
| Molecular Formula | C14H20O3 |
| Molecular Weight | 236.14125 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 236.14125 Da |
| Heavy Atoms | 17 |
| Complexity | 228.0 |
| SMILES | CCCOC1=C(C=C(C=C1)C(=O)C)OCCC |
| InChIKey | NBTJHXNUCAAKDN-UHFFFAOYSA-N |
Chemical Property Profile of 1-(3,4-Dipropoxyphenyl)ethan-1-one
Property Insights of 1-(3,4-Dipropoxyphenyl)ethan-1-one
The XLogP value of 3.6 indicates that 1-(3,4-Dipropoxyphenyl)ethan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 1-(3,4-Dipropoxyphenyl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3,4-Dipropoxyphenyl)ethan-1-one 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-(3,4-Dipropoxyphenyl)ethan-1-one?
The CAS number of 1-(3,4-Dipropoxyphenyl)ethan-1-one is 105321-59-3.
What is the molecular formula of 1-(3,4-Dipropoxyphenyl)ethan-1-one?
The molecular formula of 1-(3,4-Dipropoxyphenyl)ethan-1-one is C14H20O3.
What is the molecular weight of 1-(3,4-Dipropoxyphenyl)ethan-1-one?
The molecular weight of 1-(3,4-Dipropoxyphenyl)ethan-1-one is 236.14125 g/mol.
Where can I buy 1-(3,4-Dipropoxyphenyl)ethan-1-one?
You can request a quote for 1-(3,4-Dipropoxyphenyl)ethan-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(3,4-Dipropoxyphenyl)ethan-1-one?
Yes, CoreyChem provides custom synthesis services for 1-(3,4-Dipropoxyphenyl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.