TL;DR: 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one (CAS 10534-37-9) is a chemical compound with molecular formula C15H28O and molecular weight 224.21402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methyl-4-(4-propan-2-ylcyclohexyl)pentan-2-one
Also Known As: 4-methyl-4-(4-propan-2-ylcyclohexyl)pentan-2-one, 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one, 4-(4-isopropylcyclohexyl)-4-methylpentan-2-one, 4-[4-(ISOPROPYL)CYCLOHEXYL]-4-METHYLPENTAN-2-ONE, 4-methyl-4-[4-(propan-2-yl)cyclohexyl]pentan-2-one
| Molecular Formula | C15H28O |
| Molecular Weight | 224.21402 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 224.21402 Da |
| Heavy Atoms | 16 |
| Complexity | 232.0 |
| SMILES | CC(C)C1CCC(CC1)C(C)(C)CC(=O)C |
| InChIKey | RLPJJOKZQQYRCM-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one is 10534-37-9.
The molecular formula of 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one is C15H28O.
The molecular weight of 4-(4-(Isopropyl)cyclohexyl)-4-methylpentan-2-one is 224.21402 g/mol.
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