Ethyl 3-amino-4-ethoxybenzoate
TL;DR: Ethyl 3-amino-4-ethoxybenzoate (CAS 141238-15-5) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.1052 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 3-amino-4-ethoxybenzoate
Also Known As: ethyl 3-amino-4-ethoxybenzoate, BEN143, Benzoic acid, 3-amino-4-ethoxy-, ethyl ester (9CI), 3-Amino-4-ethoxy-benzoic acid ethyl ester, Benzoic acid, 3-amino-4-ethoxy-, ethyl ester
Technical Specifications
| Molecular Formula | C11H15NO3 |
| Molecular Weight | 209.1052 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 209.1052 Da |
| Heavy Atoms | 15 |
| Complexity | 208.0 |
| SMILES | CCOC1=C(C=C(C=C1)C(=O)OCC)N |
| InChIKey | WKWDSLKXVGZOKZ-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 3-amino-4-ethoxybenzoate
Property Insights of Ethyl 3-amino-4-ethoxybenzoate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-amino-4-ethoxybenzoate. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-amino-4-ethoxybenzoate. Following Lipinski's Rule of Five, Ethyl 3-amino-4-ethoxybenzoate 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 Ethyl 3-amino-4-ethoxybenzoate?
The CAS number of Ethyl 3-amino-4-ethoxybenzoate is 141238-15-5.
What is the molecular formula of Ethyl 3-amino-4-ethoxybenzoate?
The molecular formula of Ethyl 3-amino-4-ethoxybenzoate is C11H15NO3.
What is the molecular weight of Ethyl 3-amino-4-ethoxybenzoate?
The molecular weight of Ethyl 3-amino-4-ethoxybenzoate is 209.1052 g/mol.
Where can I buy Ethyl 3-amino-4-ethoxybenzoate?
You can request a quote for Ethyl 3-amino-4-ethoxybenzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 3-amino-4-ethoxybenzoate?
Yes, CoreyChem provides custom synthesis services for Ethyl 3-amino-4-ethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.