TL;DR: 2-Isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine (CAS 159527-18-1) is a chemical compound with molecular formula C14H18O2 and molecular weight 218.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-propan-2-yl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine
Also Known As: BAS 00189894, 2-isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine, 3-Isopropyl-1,4a,9,9a-tetrahydro-2,4-dioxa-fluorene, 2-propan-2-yl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine
| Molecular Formula | C14H18O2 |
| Molecular Weight | 218.13068 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 218.13068 Da |
| Heavy Atoms | 16 |
| Complexity | 251.0 |
| SMILES | CC(C)C1OCC2CC3=CC=CC=C3C2O1 |
| InChIKey | NOBNLHDWQDMAEA-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2-Isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2-Isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine has 0 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-Isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine is 159527-18-1.
The molecular formula of 2-Isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine is C14H18O2.
The molecular weight of 2-Isopropyl-4,4a,5,9b-tetrahydroindeno[1,2-d][1,3]dioxine is 218.13068 g/mol.
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