TL;DR: 1(2H)-Naphthalenone, 3,4-dihydro-3,6,8-trihydroxy-, (3R)- (CAS 144068-45-1) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,6,8-trihydroxy-3,4-dihydro-2H-naphthalen-1-one
Also Known As: Scytalone, 3,6,8-trihydroxytetralone, Pyrimidine-5-carboxylic acid, 3,6,8-Trihydroxytetralin-1-one, 3,6,8-trihydroxy-3,4-dihydro-2H-naphthalen-1-one
| Molecular Formula | C10H10O4 |
| Molecular Weight | 194.0579 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.0579 Da |
| Heavy Atoms | 14 |
| Complexity | 240.0 |
| SMILES | C1C(CC(=O)C2=C1C=C(C=C2O)O)O |
| InChIKey | RTWVXIIKUFSDJB-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1(2H)-Naphthalenone, 3,4-dihydro-3,6,8-trihydroxy-, (3R)-. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1(2H)-Naphthalenone, 3,4-dihydro-3,6,8-trihydroxy-, (3R)-. Following Lipinski's Rule of Five, 1(2H)-Naphthalenone, 3,4-dihydro-3,6,8-trihydroxy-, (3R)- has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1(2H)-Naphthalenone, 3,4-dihydro-3,6,8-trihydroxy-, (3R)- is 144068-45-1.
The molecular formula of 1(2H)-Naphthalenone, 3,4-dihydro-3,6,8-trihydroxy-, (3R)- is C10H10O4.
The molecular weight of 1(2H)-Naphthalenone, 3,4-dihydro-3,6,8-trihydroxy-, (3R)- is 194.0579 g/mol.
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