Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate
TL;DR: Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate (CAS 613656-32-9) is a chemical compound with molecular formula C13H19NO4 and molecular weight 253.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate
Also Known As: methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate, methyl 3-amino-3-(3-methoxy-4-ethoxy-phenyl)propionate, Methyl 3-amino-3-(4-ethoxy-3-methoxy-phenyl)propanoate
| Molecular Formula | C13H19NO4 |
|---|---|
| Molecular Weight | 253.13 g/mol |
| LogP | 1.6568 |
| Topological Polar Surface Area | 70.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 253.13141 |
| Heavy Atoms | 18 |
| Complexity | 405.97775 |
Chemical Identifiers
| CAS Number | 613656-32-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C(CC(=O)OC)N)OC |
Product Overview
Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate (CAS 613656-32-9), with molecular formula C13H19NO4 and molecular weight 253.13 g/mol. IUPAC: methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate.
Chemical Property Profile of Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate
Property Insights of Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate
The XLogP value of 1.6568 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate. The TPSA of 70.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate. Following Lipinski's Rule of Five, Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate has 1 hydrogen bond donor(s) and 5 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 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate?
The CAS number of Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate is 613656-32-9.
What is the molecular formula of Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate?
The molecular formula of Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate is C13H19NO4.
What is the molecular weight of Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate?
The molecular weight of Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate is 253.13 g/mol.
Where can I buy Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate?
You can request a quote for Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-amino-3-(4-ethoxy-3-methoxyphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.