(2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one
TL;DR: (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one (CAS 110901-27-4) 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.
(2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one
Also Known As: 2,4,5-Thto, 2,4,5-Trihydroxy-3,4-dihydronaphthalen-1(2H)-one, (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one, (2R,4S)-2,4,5-trihydroxy-3,4-dihydronaphthalen-1(2H)-one, 3,4-Dihydro-2,4,5-trihydroxy-1(2H)-naphthalenone cis-(+-)-
Technical Specifications
| Molecular Formula | C10H10O4 |
| Molecular Weight | 194.0579 g/mol |
| XLogP | 0.0 |
| 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 | C1[C@@H](C2=C(C=CC=C2O)C(=O)[C@@H]1O)O |
| InChIKey | IWQBULDDQSARRE-JGVFFNPUSA-N |
Chemical Property Profile of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one
Property Insights of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one. Following Lipinski's Rule of Five, (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one?
The CAS number of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one is 110901-27-4.
What is the molecular formula of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one?
The molecular formula of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one is C10H10O4.
What is the molecular weight of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one?
The molecular weight of (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one is 194.0579 g/mol.
Where can I buy (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one?
You can request a quote for (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one?
Yes, CoreyChem provides custom synthesis services for (2R,4S)-2,4,5-trihydroxy-3,4-dihydro-2H-naphthalen-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.