TL;DR: 2,2',2'',2'''-(Methanetetrayltetrakis(oxy))tetrakispropane (CAS 36597-49-6) is a chemical compound with molecular formula C13H28O4 and molecular weight 248.19876 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[tri(propan-2-yloxy)methoxy]propane
Also Known As: Tetraisopropoxymethane, Tetraisopropyl orthocarbonate, Tetra(isopropyloxy)methane, Tetraisopropylorthocarbonate, Tetra-isopropylorthocarbonat
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C13H28O4 |
| Molecular Weight | 248.19876 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 248.19876 Da |
| Heavy Atoms | 17 |
| Complexity | 154.0 |
| SMILES | CC(C)OC(OC(C)C)(OC(C)C)OC(C)C |
| InChIKey | PUAUAWJVTROGJG-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2,2',2'',2'''-(Methanetetrayltetrakis(oxy))tetrakispropane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.9 Ų, 2,2',2'',2'''-(Methanetetrayltetrakis(oxy))tetrakispropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2',2'',2'''-(Methanetetrayltetrakis(oxy))tetrakispropane has 0 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 2,2',2'',2'''-(Methanetetrayltetrakis(oxy))tetrakispropane is 36597-49-6.
The molecular formula of 2,2',2'',2'''-(Methanetetrayltetrakis(oxy))tetrakispropane is C13H28O4.
The molecular weight of 2,2',2'',2'''-(Methanetetrayltetrakis(oxy))tetrakispropane is 248.19876 g/mol.
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