TL;DR: 2-[4-(3-Methylbutoxy)phenyl]ethanol (CAS 106379-94-6) is a chemical compound with molecular formula C13H20O2 and molecular weight 208.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(3-methylbutoxy)phenyl]ethanol
Also Known As: 4-iso-Pentoxyphenethyl alcohol, starbld0022491, 2-[4-(3-methylbutoxy)phenyl]ethanol, p-isopentyloxyphenethyl alcohol, 4-Isopentyloxy-phenaethylalkohol
| Molecular Formula | C13H20O2 |
| Molecular Weight | 208.14633 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 208.14633 Da |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
| SMILES | CC(C)CCOC1=CC=C(C=C1)CCO |
| InChIKey | AWGBFRSYZISKQM-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that 2-[4-(3-Methylbutoxy)phenyl]ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 2-[4-(3-Methylbutoxy)phenyl]ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(3-Methylbutoxy)phenyl]ethanol 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 2-[4-(3-Methylbutoxy)phenyl]ethanol is 106379-94-6.
The molecular formula of 2-[4-(3-Methylbutoxy)phenyl]ethanol is C13H20O2.
The molecular weight of 2-[4-(3-Methylbutoxy)phenyl]ethanol is 208.14633 g/mol.
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