TL;DR: Phenol, 4-(2-methylbutoxy)- (CAS 67599-20-6) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-methylbutoxy)phenol
Also Known As: 4-(2-methylbutoxy)phenol, Phenol, 4-(2-methylbutoxy)-, 4-(2-methylbutoxy)benzenol, Bionet2_000362, 4-(2-Methyl-Butoxy)Benzenol
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H16O2 |
| Molecular Weight | 180.11504 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.11504 Da |
| Heavy Atoms | 13 |
| Complexity | 128.0 |
| SMILES | CCC(C)COC1=CC=C(C=C1)O |
| InChIKey | GCQBIYCSSJYFJX-UHFFFAOYSA-N |
The XLogP value of 3.2 indicates that Phenol, 4-(2-methylbutoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Phenol, 4-(2-methylbutoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 4-(2-methylbutoxy)- 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 Phenol, 4-(2-methylbutoxy)- is 67599-20-6.
The molecular formula of Phenol, 4-(2-methylbutoxy)- is C11H16O2.
The molecular weight of Phenol, 4-(2-methylbutoxy)- is 180.11504 g/mol.
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