Methyl 2-(4-aminophenyl)propionate
TL;DR: Methyl 2-(4-aminophenyl)propionate (CAS 39718-97-3) is a chemical compound with molecular formula C10H13NO2 and molecular weight 179.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(4-aminophenyl)propanoate
Also Known As: methyl 2-(4-aminophenyl)propanoate, Methyl 2-(4-aminophenyl)propionate, methyl 2-(4-aminophenyl)propionate, methyl 4-aminophenylpropionate, EINECS 254-605-1
| Molecular Formula | C10H13NO2 |
|---|---|
| Molecular Weight | 179.09 g/mol |
| LogP | 1.5453 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.09464 |
| Heavy Atoms | 13 |
| Complexity | 292.29797 |
Chemical Identifiers
| CAS Number | 39718-97-3 |
|---|---|
| SMILES | CC(C1=CC=C(C=C1)N)C(=O)OC |
Product Overview
Methyl 2-(4-aminophenyl)propionate (CAS 39718-97-3), with molecular formula C10H13NO2 and molecular weight 179.09 g/mol. IUPAC: methyl 2-(4-aminophenyl)propanoate.
Chemical Property Profile of Methyl 2-(4-aminophenyl)propionate
Property Insights of Methyl 2-(4-aminophenyl)propionate
The XLogP value of 1.5453 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-(4-aminophenyl)propionate. With a topological polar surface area (TPSA) of 52.32 Ų, Methyl 2-(4-aminophenyl)propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(4-aminophenyl)propionate has 1 hydrogen bond donor(s) and 3 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-(4-aminophenyl)propionate?
The CAS number of Methyl 2-(4-aminophenyl)propionate is 39718-97-3.
What is the molecular formula of Methyl 2-(4-aminophenyl)propionate?
The molecular formula of Methyl 2-(4-aminophenyl)propionate is C10H13NO2.
What is the molecular weight of Methyl 2-(4-aminophenyl)propionate?
The molecular weight of Methyl 2-(4-aminophenyl)propionate is 179.09 g/mol.
Where can I buy Methyl 2-(4-aminophenyl)propionate?
You can request a quote for Methyl 2-(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-(4-aminophenyl)propionate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(4-aminophenyl)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.