4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester
TL;DR: 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester (CAS 123354-93-8) is a chemical compound with molecular formula C14H21NO3 and molecular weight 251.15215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(propan-2-ylamino)ethyl 4-ethoxybenzoate
Also Known As: Ebz-ipae, 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester, 2-(propan-2-ylamino)ethyl 4-ethoxybenzoate, 2-(isopropylamino)ethyl 4-ethoxybenzoate, 2-((1-Methylethyl)amino)ethyl 4-ethoxybenzoate
Technical Specifications
| Molecular Formula | C14H21NO3 |
| Molecular Weight | 251.15215 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 251.15215 Da |
| Heavy Atoms | 18 |
| Complexity | 235.0 |
| SMILES | CCOC1=CC=C(C=C1)C(=O)OCCNC(C)C |
| InChIKey | IHSIQLCMWPVNCC-UHFFFAOYSA-N |
Chemical Property Profile of 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester
Property Insights of 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester
The XLogP value of 3.4 indicates that 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester has 1 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-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester?
The CAS number of 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester is 123354-93-8.
What is the molecular formula of 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester?
The molecular formula of 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester is C14H21NO3.
What is the molecular weight of 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester?
The molecular weight of 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester is 251.15215 g/mol.
Where can I buy 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester?
You can request a quote for 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester?
Yes, CoreyChem provides custom synthesis services for 4-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.