TL;DR: trans-7,8-Dihydroxy-7,8-dihydrofluoranthene (CAS 105777-13-7) is a chemical compound with molecular formula C16H12O2 and molecular weight 236.08372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(7S,8S)-7,8-dihydrofluoranthene-7,8-diol
Also Known As: trans-7,8-Dihydroxy-7,8-dihydrofluoranthene, 7,8-FLUORANTHENEDIOL, 7,8-DIHYDRO-, trans-, (7S,8S)-7,8-dihydrofluoranthene-7,8-diol, CCRIS 2179
| Molecular Formula | C16H12O2 |
| Molecular Weight | 236.08372 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 236.08372 Da |
| Heavy Atoms | 18 |
| Complexity | 423.0 |
| SMILES | C1=CC2=C3C(=C1)C4=C(C3=CC=C2)[C@@H]([C@H](C=C4)O)O |
| InChIKey | CRERAKOPKUUDEY-XJKSGUPXSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-7,8-Dihydroxy-7,8-dihydrofluoranthene. With a topological polar surface area (TPSA) of 40.5 Ų, trans-7,8-Dihydroxy-7,8-dihydrofluoranthene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-7,8-Dihydroxy-7,8-dihydrofluoranthene has 2 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 trans-7,8-Dihydroxy-7,8-dihydrofluoranthene is 105777-13-7.
The molecular formula of trans-7,8-Dihydroxy-7,8-dihydrofluoranthene is C16H12O2.
The molecular weight of trans-7,8-Dihydroxy-7,8-dihydrofluoranthene is 236.08372 g/mol.
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