TL;DR: (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid (CAS 107057-89-6) is a chemical compound with molecular formula C12H12O2 and molecular weight 188.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid
Also Known As: 4-methyl-5-phenylpenta-2,4-dienoic acid, (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid, 4-methyl-5-phenyl-2,4-pentadienoic acid, 5-Phenyl-4-methylpenta-2,4-dienoic acid, 4-methyl-5-phenyl-penta-2,4-dienoic Acid
| Molecular Formula | C12H12O2 |
| Molecular Weight | 188.08372 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 188.08372 Da |
| Heavy Atoms | 14 |
| Complexity | 245.0 |
| SMILES | C/C(=C\C1=CC=CC=C1)/C=C/C(=O)O |
| InChIKey | NWKUGDBRICNTTN-XBLVEGMJSA-N |
The XLogP value of 3.1 indicates that (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid 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 (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid is 107057-89-6.
The molecular formula of (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid is C12H12O2.
The molecular weight of (2E,4E)-4-methyl-5-phenylpenta-2,4-dienoic acid is 188.08372 g/mol.
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