Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate
TL;DR: Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate (CAS 148806-54-6) is a chemical compound with molecular formula C13H19NO4 and molecular weight 253.13141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate
Also Known As: ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate, Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propionate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H19NO4 |
| Molecular Weight | 253.13141 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 70.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 253.13141 Da |
| Heavy Atoms | 18 |
| Complexity | 259.0 |
| SMILES | CCOC(=O)C(CC1=CC(=C(C=C1)OC)OC)N |
| InChIKey | CKPXBRGEMOUHQJ-UHFFFAOYSA-N |
Chemical Property Profile of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate
Property Insights of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate. The TPSA of 70.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate. Following Lipinski's Rule of Five, Ethyl 2-amino-3-(3,4-dimethoxyphenyl)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
What is the CAS number of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate?
The CAS number of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate is 148806-54-6.
What is the molecular formula of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate?
The molecular formula of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate is C13H19NO4.
What is the molecular weight of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate?
The molecular weight of Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate is 253.13141 g/mol.
Where can I buy Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate?
You can request a quote for Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate?
Yes, CoreyChem provides custom synthesis services for Ethyl 2-amino-3-(3,4-dimethoxyphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.