(S)-Ethyl 3-amino-3-phenylpropanoate
TL;DR: (S)-Ethyl 3-amino-3-phenylpropanoate (CAS 3082-69-7) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (3S)-3-amino-3-phenylpropanoate
Also Known As: ethyl (3S)-3-amino-3-phenylpropanoate, (S)-Ethyl 3-amino-3-phenylpropanoate, d-beta-phenylalanine ethyl ester, Ethyl (S)-3-amino-3-phenylpropanoate, ethyl 3-amino-3-phenylpropionate
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 1.6396 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 284.59882 |
Chemical Identifiers
| CAS Number | 3082-69-7 |
|---|---|
| SMILES | CCOC(=O)C[C@@H](C1=CC=CC=C1)N |
Product Overview
(S)-Ethyl 3-amino-3-phenylpropanoate (CAS 3082-69-7), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: ethyl (3S)-3-amino-3-phenylpropanoate.
Chemical Property Profile of (S)-Ethyl 3-amino-3-phenylpropanoate
Property Insights of (S)-Ethyl 3-amino-3-phenylpropanoate
The XLogP value of 1.6396 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Ethyl 3-amino-3-phenylpropanoate. With a topological polar surface area (TPSA) of 52.32 Ų, (S)-Ethyl 3-amino-3-phenylpropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-Ethyl 3-amino-3-phenylpropanoate 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 (S)-Ethyl 3-amino-3-phenylpropanoate?
The CAS number of (S)-Ethyl 3-amino-3-phenylpropanoate is 3082-69-7.
What is the molecular formula of (S)-Ethyl 3-amino-3-phenylpropanoate?
The molecular formula of (S)-Ethyl 3-amino-3-phenylpropanoate is C11H15NO2.
What is the molecular weight of (S)-Ethyl 3-amino-3-phenylpropanoate?
The molecular weight of (S)-Ethyl 3-amino-3-phenylpropanoate is 193.11 g/mol.
Where can I buy (S)-Ethyl 3-amino-3-phenylpropanoate?
You can request a quote for (S)-Ethyl 3-amino-3-phenylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-Ethyl 3-amino-3-phenylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for (S)-Ethyl 3-amino-3-phenylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.