TL;DR: (E)-Ethyl penta-2,4-dienoate (CAS 13038-12-5) is a chemical compound with molecular formula C7H10O2 and molecular weight 126.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (2E)-penta-2,4-dienoate
Also Known As: Ethyl Penta-2,4-dienoate, (E)-Ethyl penta-2,4-dienoate, ethyl (2E)-penta-2,4-dienoate, ethyl (e)-2,4-pentadienoate, (E)-ethyl-penta-2,4-dienoate
| Molecular Formula | C7H10O2 |
| Molecular Weight | 126.06808 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 126.06808 Da |
| Heavy Atoms | 9 |
| Complexity | 125.0 |
| SMILES | CCOC(=O)/C=C/C=C |
| InChIKey | MOJNQUDSDVIYEO-AATRIKPKSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-Ethyl penta-2,4-dienoate. With a topological polar surface area (TPSA) of 26.3 Ų, (E)-Ethyl penta-2,4-dienoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-Ethyl penta-2,4-dienoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (E)-Ethyl penta-2,4-dienoate is 13038-12-5.
The molecular formula of (E)-Ethyl penta-2,4-dienoate is C7H10O2.
The molecular weight of (E)-Ethyl penta-2,4-dienoate is 126.06808 g/mol.
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