TL;DR: 5,6,8,9-Tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione (CAS 151391-92-3) is a chemical compound with molecular formula C13H10O3 and molecular weight 214.06299 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-oxatetracyclo[8.4.0.02,6.05,9]tetradeca-1(14),10,12-triene-4,7-dione
Also Known As: 5,6,8,9-tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione, 5,6,8,9-tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7
| Molecular Formula | C13H10O3 |
| Molecular Weight | 214.06299 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 214.06299 Da |
| Heavy Atoms | 16 |
| Complexity | 375.0 |
| SMILES | C1C2C3C(C1=O)C(C4=CC=CC=C24)OC3=O |
| InChIKey | BYCOICCAZRCHAN-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,6,8,9-Tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione. With a topological polar surface area (TPSA) of 43.4 Ų, 5,6,8,9-Tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6,8,9-Tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione 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 5,6,8,9-Tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione is 151391-92-3.
The molecular formula of 5,6,8,9-Tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione is C13H10O3.
The molecular weight of 5,6,8,9-Tetrahydro-7h-5,6,9-(epoxyethane[1,2,2]triyl)benzo[7]annulene-7,11-dione is 214.06299 g/mol.
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