Ethyl-4-(diethylaminoethyloxy)benzoate
TL;DR: Ethyl-4-(diethylaminoethyloxy)benzoate (CAS 70628-24-9) is a chemical compound with molecular formula C15H23NO3 and molecular weight 265.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2-(diethylamino)ethoxy]benzoate
Also Known As: ethyl-4-(diethylaminoethyloxy)benzoate, ethyl 4-[2-(diethylamino)ethoxy]benzoate, ethyl 4-(2-diethylaminoethyloxy)benzoate, Benzoic acid, 4-[2-(diethylamino)ethoxy]-, ethyl ester
| Molecular Formula | C15H23NO3 |
|---|---|
| Molecular Weight | 265.17 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 38.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 265.1678 |
| Heavy Atoms | 19 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 70628-24-9 |
|---|---|
| SMILES | CCN(CC)CCOC1=CC=C(C=C1)C(=O)OCC |
| InChIKey | DFBDIQFBEZPOBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl-4-(diethylaminoethyloxy)benzoate (CAS 70628-24-9), with molecular formula C15H23NO3 and molecular weight 265.17 g/mol. IUPAC: ethyl 4-[2-(diethylamino)ethoxy]benzoate.
Chemical Property Profile of Ethyl-4-(diethylaminoethyloxy)benzoate
Property Insights of Ethyl-4-(diethylaminoethyloxy)benzoate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl-4-(diethylaminoethyloxy)benzoate. With a topological polar surface area (TPSA) of 38.8 Ų, Ethyl-4-(diethylaminoethyloxy)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl-4-(diethylaminoethyloxy)benzoate has 0 hydrogen bond donor(s) and 4 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 Ethyl-4-(diethylaminoethyloxy)benzoate?
The CAS number of Ethyl-4-(diethylaminoethyloxy)benzoate is 70628-24-9.
What is the molecular formula of Ethyl-4-(diethylaminoethyloxy)benzoate?
The molecular formula of Ethyl-4-(diethylaminoethyloxy)benzoate is C15H23NO3.
What is the molecular weight of Ethyl-4-(diethylaminoethyloxy)benzoate?
The molecular weight of Ethyl-4-(diethylaminoethyloxy)benzoate is 265.17 g/mol.
Where can I buy Ethyl-4-(diethylaminoethyloxy)benzoate?
You can request a quote for Ethyl-4-(diethylaminoethyloxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl-4-(diethylaminoethyloxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl-4-(diethylaminoethyloxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.