Ethyl 3-phenylhydracrylate, (S)-
TL;DR: Ethyl 3-phenylhydracrylate, (S)- (CAS 72656-47-4) is a chemical compound with molecular formula C11H14O3 and molecular weight 194.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (3S)-3-hydroxy-3-phenylpropanoate
Also Known As: (S)-Ethyl 3-Hydroxy-3-phenylpropanoate, ethyl (3S)-3-hydroxy-3-phenylpropanoate, Ethyl (S)-3-phenylhydracrylate, (S)-ethyl 3-phenylhydracrylate, Ethyl 3-phenylhydracrylate, (S)-
| Molecular Formula | C11H14O3 |
|---|---|
| Molecular Weight | 194.09 g/mol |
| LogP | 1.6732 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.0943 |
| Heavy Atoms | 14 |
| Complexity | 281.84393 |
Chemical Identifiers
| CAS Number | 72656-47-4 |
|---|---|
| SMILES | CCOC(=O)C[C@@H](C1=CC=CC=C1)O |
Product Overview
Ethyl 3-phenylhydracrylate, (S)- (CAS 72656-47-4), with molecular formula C11H14O3 and molecular weight 194.09 g/mol. IUPAC: ethyl (3S)-3-hydroxy-3-phenylpropanoate.
Chemical Property Profile of Ethyl 3-phenylhydracrylate, (S)-
Property Insights of Ethyl 3-phenylhydracrylate, (S)-
The XLogP value of 1.6732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-phenylhydracrylate, (S)-. With a topological polar surface area (TPSA) of 46.53 Ų, Ethyl 3-phenylhydracrylate, (S)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 3-phenylhydracrylate, (S)- 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 3-phenylhydracrylate, (S)-?
The CAS number of Ethyl 3-phenylhydracrylate, (S)- is 72656-47-4.
What is the molecular formula of Ethyl 3-phenylhydracrylate, (S)-?
The molecular formula of Ethyl 3-phenylhydracrylate, (S)- is C11H14O3.
What is the molecular weight of Ethyl 3-phenylhydracrylate, (S)-?
The molecular weight of Ethyl 3-phenylhydracrylate, (S)- is 194.09 g/mol.
Where can I buy Ethyl 3-phenylhydracrylate, (S)-?
You can request a quote for Ethyl 3-phenylhydracrylate, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-phenylhydracrylate, (S)-?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-phenylhydracrylate, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.