TL;DR: (Z)-4-hydroxy-3-phenylpent-3-en-2-one (CAS 14179-55-6) is a chemical compound with molecular formula C11H12O2 and molecular weight 176.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(Z)-4-hydroxy-3-phenylpent-3-en-2-one
Also Known As: MeCOC(Ph):C(Me)OH, 3-phenylpentane-2,4-dione, (Z)-4-hydroxy-3-phenylpent-3-en-2-one, (3Z)-4-hydroxy-3-phenyl-3-penten-2-one, (3Z)-4-hydroxy-3-phenylpent-3-en-2-one
| Molecular Formula | C11H12O2 |
| Molecular Weight | 176.08372 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.08372 Da |
| Heavy Atoms | 13 |
| Complexity | 222.0 |
| SMILES | C/C(=C(\C1=CC=CC=C1)/C(=O)C)/O |
| InChIKey | RIQCDVHEPLIKAO-DHZHZOJOSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-4-hydroxy-3-phenylpent-3-en-2-one. With a topological polar surface area (TPSA) of 37.3 Ų, (Z)-4-hydroxy-3-phenylpent-3-en-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Z)-4-hydroxy-3-phenylpent-3-en-2-one 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 (Z)-4-hydroxy-3-phenylpent-3-en-2-one is 14179-55-6.
The molecular formula of (Z)-4-hydroxy-3-phenylpent-3-en-2-one is C11H12O2.
The molecular weight of (Z)-4-hydroxy-3-phenylpent-3-en-2-one is 176.08372 g/mol.
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