TL;DR: 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide (CAS 133611-21-9) is a chemical compound with molecular formula C14H13O3P and molecular weight 260.06024 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-phenyl-1,5-dihydro-2,4,3λ5-benzodioxaphosphepine 3-oxide
Also Known As: 3-phenyl-1,5-dihydro-2,4,3, 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide, AI-237/31666008, 2-phenyl-2-oxo-5,6-benzo-1,3,2-dioxaphosphepine, 1,5-Dihydro-3-phenyl-2,4,3-benzodioxaphosphepin 3-oxide
| Molecular Formula | C14H13O3P |
| Molecular Weight | 260.06024 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 260.06024 Da |
| Heavy Atoms | 18 |
| Complexity | 305.0 |
| SMILES | C1C2=CC=CC=C2COP(=O)(O1)C3=CC=CC=C3 |
| InChIKey | ZAFSLNWLKWPIJP-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide. With a topological polar surface area (TPSA) of 35.5 Ų, 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide is 133611-21-9.
The molecular formula of 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide is C14H13O3P.
The molecular weight of 2,4,3-Benzodioxaphosphepin, 1,5-dihydro-3-phenyl-, 3-oxide is 260.06024 g/mol.
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