TL;DR: (Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one (CAS 150444-56-7) is a chemical compound with molecular formula C11H12O3 and molecular weight 192.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one
Also Known As: alpha-(4-methoxybenzoyl)acetone, J2.638.674H, J3.162.524F, 4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one, 4-Hydroxy-4-(4-methoxyphenyl)-3-butene-2-one
| Molecular Formula | C11H12O3 |
| Molecular Weight | 192.07864 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 192.07864 Da |
| Heavy Atoms | 14 |
| Complexity | 225.0 |
| SMILES | CC(=O)/C=C(/C1=CC=C(C=C1)OC)\O |
| InChIKey | SCEHMWFEKYULFN-XFFZJAGNSA-N |
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one. With a topological polar surface area (TPSA) of 46.5 Ų, (Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one is 150444-56-7.
The molecular formula of (Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one is C11H12O3.
The molecular weight of (Z)-4-hydroxy-4-(4-methoxyphenyl)but-3-en-2-one is 192.07864 g/mol.
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