Ethyl 2-amino-4-phenylbutanoate
TL;DR: Ethyl 2-amino-4-phenylbutanoate (CAS 124044-66-2) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-amino-4-phenylbutanoate
Also Known As: ethyl 2-amino-4-phenylbutanoate, (-)-DibenzylD-tartrate, l-homophenylalanine ethyl ester, Ethyl 2-amino-4-phenylbutyrate, ethyl 2-amino-4-phenyl-butyrate
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 1.5096 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 297.75024 |
Chemical Identifiers
| CAS Number | 124044-66-2 |
|---|---|
| SMILES | CCOC(=O)C(CCC1=CC=CC=C1)N |
Product Overview
Ethyl 2-amino-4-phenylbutanoate (CAS 124044-66-2), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: ethyl 2-amino-4-phenylbutanoate.
Chemical Property Profile of Ethyl 2-amino-4-phenylbutanoate
Property Insights of Ethyl 2-amino-4-phenylbutanoate
The XLogP value of 1.5096 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-amino-4-phenylbutanoate. With a topological polar surface area (TPSA) of 52.32 Ų, Ethyl 2-amino-4-phenylbutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-amino-4-phenylbutanoate 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 Ethyl 2-amino-4-phenylbutanoate?
The CAS number of Ethyl 2-amino-4-phenylbutanoate is 124044-66-2.
What is the molecular formula of Ethyl 2-amino-4-phenylbutanoate?
The molecular formula of Ethyl 2-amino-4-phenylbutanoate is C12H17NO2.
What is the molecular weight of Ethyl 2-amino-4-phenylbutanoate?
The molecular weight of Ethyl 2-amino-4-phenylbutanoate is 207.13 g/mol.
Where can I buy Ethyl 2-amino-4-phenylbutanoate?
You can request a quote for Ethyl 2-amino-4-phenylbutanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-amino-4-phenylbutanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-amino-4-phenylbutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.