TL;DR: 3-(Cyclohexyloxy)propane-1,2-diol (CAS 110750-80-6) is a chemical compound with molecular formula C9H18O3 and molecular weight 174.1256 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-cyclohexyloxypropane-1,2-diol
Also Known As: Cyclohexylglycerin, 3-(cyclohexyloxy)propane-1,2-diol, 1-Cyclohexyl glycerol ether, 3-cyclohexyloxypropane-1,2-diol, ADEKA NOL CHG
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H18O3 |
| Molecular Weight | 174.1256 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 174.1256 Da |
| Heavy Atoms | 12 |
| Complexity | 110.0 |
| SMILES | C1CCC(CC1)OCC(CO)O |
| InChIKey | OWTXHZITCDRRTI-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Cyclohexyloxy)propane-1,2-diol. With a topological polar surface area (TPSA) of 49.7 Ų, 3-(Cyclohexyloxy)propane-1,2-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Cyclohexyloxy)propane-1,2-diol has 2 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 3-(Cyclohexyloxy)propane-1,2-diol is 110750-80-6.
The molecular formula of 3-(Cyclohexyloxy)propane-1,2-diol is C9H18O3.
The molecular weight of 3-(Cyclohexyloxy)propane-1,2-diol is 174.1256 g/mol.
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