ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate
TL;DR: ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate (CAS 24667-67-2) is a chemical compound with molecular formula C14H13NO2 and molecular weight 227.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate
Also Known As: ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate, 2, 2-cyano-5-phenyl-, ethyl ester, ethyl 2-cyano-5-phenylpenta-2,4-dienoate, Ethyl=2-cyano-5-phenyl-2,4-Pentadienoate, 2,4-Pentadienoic acid,2-cyano-5-phenyl-, ethyl ester
| Molecular Formula | C14H13NO2 |
|---|---|
| Molecular Weight | 227.09 g/mol |
| LogP | 2.71288 |
| Topological Polar Surface Area | 50.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.09464 |
| Heavy Atoms | 17 |
| Complexity | 466.7456 |
Chemical Identifiers
| CAS Number | 24667-67-2 |
|---|---|
| SMILES | CCOC(=O)/C(=C\C=C\C1=CC=CC=C1)/C#N |
Product Overview
ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate (CAS 24667-67-2), with molecular formula C14H13NO2 and molecular weight 227.09 g/mol. IUPAC: ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate.
Chemical Property Profile of ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate
Property Insights of ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate
The XLogP value of 2.71288 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate. With a topological polar surface area (TPSA) of 50.09 Ų, ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate has 0 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 (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate?
The CAS number of ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate is 24667-67-2.
What is the molecular formula of ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate?
The molecular formula of ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate is C14H13NO2.
What is the molecular weight of ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate?
The molecular weight of ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate is 227.09 g/mol.
Where can I buy ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate?
You can request a quote for ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl (2Z,4E)-2-cyano-5-phenylpenta-2,4-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.