TL;DR: (2R)-2,4,4-trimethylpentan-1-ol (CAS 1637438-45-9) is a chemical compound with molecular formula C8H18O and molecular weight 130.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2R)-2,4,4-trimethylpentan-1-ol
Also Known As: (2R)-2,4,4-trimethylpentan-1-ol, 2,4,4-Trimethyl-1-pentanol
| Molecular Formula | C8H18O |
| Molecular Weight | 130.13577 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 130.13577 Da |
| Heavy Atoms | 9 |
| Complexity | 71.0 |
| SMILES | C[C@H](CC(C)(C)C)CO |
| InChIKey | ZNRVRWHPZZOTIE-SSDOTTSWSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R)-2,4,4-trimethylpentan-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, (2R)-2,4,4-trimethylpentan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2R)-2,4,4-trimethylpentan-1-ol has 1 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 (2R)-2,4,4-trimethylpentan-1-ol is 1637438-45-9.
The molecular formula of (2R)-2,4,4-trimethylpentan-1-ol is C8H18O.
The molecular weight of (2R)-2,4,4-trimethylpentan-1-ol is 130.13577 g/mol.
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