Methyl 2-ethoxy-3-(4-aminophenyl)propionate
TL;DR: Methyl 2-ethoxy-3-(4-aminophenyl)propionate (CAS 515861-40-2) is a chemical compound with molecular formula C12H17NO3 and molecular weight 223.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4-aminophenyl)-2-ethoxypropanoate
Also Known As: methyl 2-ethoxy-3-(4-aminophenyl)propionate, Methyl 2-ethoxy-3-(4-aminophenyl)propanoate, Methyl 3-(4-aminophenyl)-2-ethoxy-propanoate
| Molecular Formula | C12H17NO3 |
|---|---|
| Molecular Weight | 223.12 g/mol |
| LogP | 1.3894 |
| Topological Polar Surface Area | 61.55 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 223.12085 |
| Heavy Atoms | 16 |
| Complexity | 334.62204 |
Chemical Identifiers
| CAS Number | 515861-40-2 |
|---|---|
| SMILES | CCOC(CC1=CC=C(C=C1)N)C(=O)OC |
Product Overview
Methyl 2-ethoxy-3-(4-aminophenyl)propionate (CAS 515861-40-2), with molecular formula C12H17NO3 and molecular weight 223.12 g/mol. IUPAC: methyl 3-(4-aminophenyl)-2-ethoxypropanoate.
Chemical Property Profile of Methyl 2-ethoxy-3-(4-aminophenyl)propionate
Property Insights of Methyl 2-ethoxy-3-(4-aminophenyl)propionate
The XLogP value of 1.3894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-ethoxy-3-(4-aminophenyl)propionate. The TPSA of 61.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-ethoxy-3-(4-aminophenyl)propionate. Following Lipinski's Rule of Five, Methyl 2-ethoxy-3-(4-aminophenyl)propionate 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
Frequently Asked Questions
What is the CAS number of Methyl 2-ethoxy-3-(4-aminophenyl)propionate?
The CAS number of Methyl 2-ethoxy-3-(4-aminophenyl)propionate is 515861-40-2.
What is the molecular formula of Methyl 2-ethoxy-3-(4-aminophenyl)propionate?
The molecular formula of Methyl 2-ethoxy-3-(4-aminophenyl)propionate is C12H17NO3.
What is the molecular weight of Methyl 2-ethoxy-3-(4-aminophenyl)propionate?
The molecular weight of Methyl 2-ethoxy-3-(4-aminophenyl)propionate is 223.12 g/mol.
Where can I buy Methyl 2-ethoxy-3-(4-aminophenyl)propionate?
You can request a quote for Methyl 2-ethoxy-3-(4-aminophenyl)propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-ethoxy-3-(4-aminophenyl)propionate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-ethoxy-3-(4-aminophenyl)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.