TL;DR: Formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane (CAS 63428-91-1) is a chemical compound with molecular formula C17H28O4 and molecular weight 296.19876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane
Also Known As: (C11-H16-O.C3-H6-O.C2-H4-O.C-H2-O)x-, Formaldehyde p-tert-amylphenol propylene oxide ethylene oxide polymer, Formaldehyde, polymer with p-tert-amylphenol, methyloxirane and oxirane, formaldehyde; 4-(2-methylbutan-2-yl)phenol; 2-methyloxirane; oxirane, p-tert-Amylphenol, formaldehyde, ethylene oxide, propylene oxide polymer
| Molecular Formula | C17H28O4 |
| Molecular Weight | 296.19876 g/mol |
| XLogP | 3.32 |
| Topological Polar Surface Area (TPSA) | 62.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.19876 Da |
| Heavy Atoms | 21 |
| Complexity | 171.0 |
| SMILES | CCC(C)(C)C1=CC=C(C=C1)O.CC1CO1.C=O.C1CO1 |
| InChIKey | SPEZSLLCUQOEJZ-UHFFFAOYSA-N |
The XLogP value of 3.32 indicates that Formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane. Following Lipinski's Rule of Five, Formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane is 63428-91-1.
The molecular formula of Formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane is C17H28O4.
The molecular weight of Formaldehyde;4-(2-methylbutan-2-yl)phenol;2-methyloxirane;oxirane is 296.19876 g/mol.
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