(e)-3-Phenyl-acrylimidic acid ethyl ester
TL;DR: (e)-3-Phenyl-acrylimidic acid ethyl ester (CAS 122490-12-4) is a chemical compound with molecular formula C11H13NO and molecular weight 175.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-phenylprop-2-enimidate
Also Known As: ethyl 3-phenylprop-2-enimidate, ethyl (E)-3-phenylprop-2-enimidate, 2-ethoxy-4-phenyl-1-aza-1,3-butadiene, 3-Phenyl-2-propenimidic acid ethyl ester, (e)-3-phenyl-acrylimidic acid ethyl ester
| Molecular Formula | C11H13NO |
|---|---|
| Molecular Weight | 175.10 g/mol |
| LogP | 2.71357 |
| Topological Polar Surface Area | 33.08 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 175.09972 |
| Heavy Atoms | 13 |
| Complexity | 290.2184 |
Chemical Identifiers
| CAS Number | 122490-12-4 |
|---|---|
| SMILES | CCOC(=N)/C=C/C1=CC=CC=C1 |
Product Overview
(e)-3-Phenyl-acrylimidic acid ethyl ester (CAS 122490-12-4), with molecular formula C11H13NO and molecular weight 175.10 g/mol. IUPAC: ethyl (E)-3-phenylprop-2-enimidate.
Chemical Property Profile of (e)-3-Phenyl-acrylimidic acid ethyl ester
Property Insights of (e)-3-Phenyl-acrylimidic acid ethyl ester
The XLogP value of 2.71357 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (e)-3-Phenyl-acrylimidic acid ethyl ester. With a topological polar surface area (TPSA) of 33.08 Ų, (e)-3-Phenyl-acrylimidic acid ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (e)-3-Phenyl-acrylimidic acid ethyl ester has 1 hydrogen bond donor(s) and 2 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 (e)-3-Phenyl-acrylimidic acid ethyl ester?
The CAS number of (e)-3-Phenyl-acrylimidic acid ethyl ester is 122490-12-4.
What is the molecular formula of (e)-3-Phenyl-acrylimidic acid ethyl ester?
The molecular formula of (e)-3-Phenyl-acrylimidic acid ethyl ester is C11H13NO.
What is the molecular weight of (e)-3-Phenyl-acrylimidic acid ethyl ester?
The molecular weight of (e)-3-Phenyl-acrylimidic acid ethyl ester is 175.10 g/mol.
Where can I buy (e)-3-Phenyl-acrylimidic acid ethyl ester?
You can request a quote for (e)-3-Phenyl-acrylimidic acid ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (e)-3-Phenyl-acrylimidic acid ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for (e)-3-Phenyl-acrylimidic acid ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.