Ethyl penta-2,3-dienoate
TL;DR: Ethyl penta-2,3-dienoate (CAS 74268-51-2) is a chemical compound with molecular formula C7H10O2 and molecular weight 126.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl penta-2,3-dienoate
Also Known As: ethyl penta-2,3-dienoate, Ethyl 2,3-pentadienoate, starbld0014084, 2,3-Pentadienoic acid,ethyl ester, Ethyl 2,3-pentadienoate #
| Molecular Formula | C7H10O2 |
|---|---|
| Molecular Weight | 126.07 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 126.06808 |
| Heavy Atoms | 9 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 74268-51-2 |
|---|---|
| SMILES | CCOC(=O)C=C=CC |
| InChIKey | JGEKOPSQLCPNGA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl penta-2,3-dienoate (CAS 74268-51-2), with molecular formula C7H10O2 and molecular weight 126.07 g/mol. IUPAC: ethyl penta-2,3-dienoate.
Chemical Property Profile of Ethyl penta-2,3-dienoate
Property Insights of Ethyl penta-2,3-dienoate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl penta-2,3-dienoate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethyl penta-2,3-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl penta-2,3-dienoate has 0 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 Ethyl penta-2,3-dienoate?
The CAS number of Ethyl penta-2,3-dienoate is 74268-51-2.
What is the molecular formula of Ethyl penta-2,3-dienoate?
The molecular formula of Ethyl penta-2,3-dienoate is C7H10O2.
What is the molecular weight of Ethyl penta-2,3-dienoate?
The molecular weight of Ethyl penta-2,3-dienoate is 126.07 g/mol.
Where can I buy Ethyl penta-2,3-dienoate?
You can request a quote for Ethyl penta-2,3-dienoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl penta-2,3-dienoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl penta-2,3-dienoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.