TL;DR: 2,4-Heptadienoic acid, (2E,4E)- (CAS 128397-09-1) 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.
(2E,4E)-hepta-2,4-dienoic acid
Also Known As: 2,4-Heptadienoic acid, Hyptadienic acid, hepta-2,4-dienoic acid, (2E,4E)-hepta-2,4-dienoic acid, 2,4-Heptadienoicacid
| Molecular Formula | C7H10O2 |
| Molecular Weight | 126.06808 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 126.06808 Da |
| Heavy Atoms | 9 |
| Complexity | 134.0 |
| SMILES | CC/C=C/C=C/C(=O)O |
| InChIKey | GYTGOLDQGRPDNF-VNKDHWASSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Heptadienoic acid, (2E,4E)-. With a topological polar surface area (TPSA) of 37.3 Ų, 2,4-Heptadienoic acid, (2E,4E)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Heptadienoic acid, (2E,4E)- has 1 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 2,4-Heptadienoic acid, (2E,4E)- is 128397-09-1.
The molecular formula of 2,4-Heptadienoic acid, (2E,4E)- is C7H10O2.
The molecular weight of 2,4-Heptadienoic acid, (2E,4E)- is 126.06808 g/mol.
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