Phenyl 3-ethoxy-3-iminopropionate
TL;DR: Phenyl 3-ethoxy-3-iminopropionate (CAS 19282-87-2) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 3-ethoxy-3-iminopropanoate
Also Known As: Phenyl 3-ethoxy-3-iminopropionate, phenyl 3-ethoxy-3-iminopropanoate, phenyl(3z)-3-ethoxy-3-iminopropanoate, 3-Ethoxy-3-iminopropionic acid phenyl ester, Propanoic acid,3-ethoxy-3-imino-, phenyl ester
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 59.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 19282-87-2 |
|---|---|
| SMILES | CCOC(=N)CC(=O)OC1=CC=CC=C1 |
| InChIKey | UPPLLLGNILNJOR-UHFFFAOYSA-N |
Product Overview
Phenyl 3-ethoxy-3-iminopropionate (CAS 19282-87-2), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: phenyl 3-ethoxy-3-iminopropanoate.
Chemical Property Profile of Phenyl 3-ethoxy-3-iminopropionate
Property Insights of Phenyl 3-ethoxy-3-iminopropionate
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl 3-ethoxy-3-iminopropionate. With a topological polar surface area (TPSA) of 59.4 Ų, Phenyl 3-ethoxy-3-iminopropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl 3-ethoxy-3-iminopropionate 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
Frequently Asked Questions
What is the CAS number of Phenyl 3-ethoxy-3-iminopropionate?
The CAS number of Phenyl 3-ethoxy-3-iminopropionate is 19282-87-2.
What is the molecular formula of Phenyl 3-ethoxy-3-iminopropionate?
The molecular formula of Phenyl 3-ethoxy-3-iminopropionate is C11H13NO3.
What is the molecular weight of Phenyl 3-ethoxy-3-iminopropionate?
The molecular weight of Phenyl 3-ethoxy-3-iminopropionate is 207.09 g/mol.
Where can I buy Phenyl 3-ethoxy-3-iminopropionate?
You can request a quote for Phenyl 3-ethoxy-3-iminopropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 3-ethoxy-3-iminopropionate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 3-ethoxy-3-iminopropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.