TL;DR: Tetraphenylnaphthacene monoxide (CAS 127257-80-1) is a chemical compound with molecular formula C42H28O and molecular weight 548.214 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,10,12-tetraphenyl-19-oxapentacyclo[10.6.1.02,11.04,9.013,18]nonadeca-2,4,6,8,10,13,15,17-octaene
Also Known As: Tetraphenylnaphthacene monoxide, J2.942.372E, 5,6,11,12-tetraphenyl-5,12-dihydro-5,12-epoxytetracene, 5,6,11,12-Tetraphenyl-5,12-dihydro-5,12-epoxynaphthacene, 1,3,10,12-tetraphenyl-19-oxapentacyclo[10.6.1.02,11.04,9.013,18]nonadeca-2(11),3,5,7,9,13,15,17-octaene
| Molecular Formula | C42H28O |
| Molecular Weight | 548.214 g/mol |
| XLogP | 10.1 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 548.214 Da |
| Heavy Atoms | 43 |
| Complexity | 872.0 |
| SMILES | C1=CC=C(C=C1)C2=C3C(=C(C4=CC=CC=C42)C5=CC=CC=C5)C6(C7=CC=CC=C7C3(O6)C8=CC=CC=C8)C9=CC=CC=C9 |
| InChIKey | RHSJHTZJVINNOH-UHFFFAOYSA-N |
The XLogP value of 10.1 indicates that Tetraphenylnaphthacene monoxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Tetraphenylnaphthacene monoxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetraphenylnaphthacene monoxide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tetraphenylnaphthacene monoxide is 127257-80-1.
The molecular formula of Tetraphenylnaphthacene monoxide is C42H28O.
The molecular weight of Tetraphenylnaphthacene monoxide is 548.214 g/mol.
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