Ethyl 3-(3-Aminophenyl)propionate
TL;DR: Ethyl 3-(3-Aminophenyl)propionate (CAS 10039-64-2) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-(3-aminophenyl)propanoate
Also Known As: Ethyl 3-(3-Aminophenyl)propionate, ethyl 3-(3-aminophenyl)propanoate, Acetylmercapto-cyclohexan, Ethyl 3-(m-aminophenyl)propionate, Ethyl3-(3-Aminophenyl)propionate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H15NO2 |
| Molecular Weight | 193.11028 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 193.11028 Da |
| Heavy Atoms | 14 |
| Complexity | 182.0 |
| SMILES | CCOC(=O)CCC1=CC(=CC=C1)N |
| InChIKey | CUNKFKQHEJGIIB-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 3-(3-Aminophenyl)propionate
Property Insights of Ethyl 3-(3-Aminophenyl)propionate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(3-Aminophenyl)propionate. With a topological polar surface area (TPSA) of 52.3 Ų, Ethyl 3-(3-Aminophenyl)propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-(3-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
What is the CAS number of Ethyl 3-(3-Aminophenyl)propionate?
The CAS number of Ethyl 3-(3-Aminophenyl)propionate is 10039-64-2.
What is the molecular formula of Ethyl 3-(3-Aminophenyl)propionate?
The molecular formula of Ethyl 3-(3-Aminophenyl)propionate is C11H15NO2.
What is the molecular weight of Ethyl 3-(3-Aminophenyl)propionate?
The molecular weight of Ethyl 3-(3-Aminophenyl)propionate is 193.11028 g/mol.
Where can I buy Ethyl 3-(3-Aminophenyl)propionate?
You can request a quote for Ethyl 3-(3-Aminophenyl)propionate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 3-(3-Aminophenyl)propionate?
Yes, CoreyChem provides custom synthesis services for Ethyl 3-(3-Aminophenyl)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.