3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone
TL;DR: 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone (CAS 49598-85-8) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3,6,8-trihydroxy-3,4-dihydro-2H-naphthalen-1-one
Also Known As: Scytalone, (3S)-3,6,8-trihydroxytetralin-1-one, 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone, (3S)-3,6,8-trihydroxy-3,4-dihydro-2H-naphthalen-1-one, 3,4-Dihydro-3,6,8-trihydroxy-1(2H)naphthalenone
| Molecular Formula | C10H10O4 |
|---|---|
| Molecular Weight | 194.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.0579 |
| Heavy Atoms | 14 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 49598-85-8 |
|---|---|
| SMILES | C1[C@@H](CC(=O)C2=C1C=C(C=C2O)O)O |
| InChIKey | RTWVXIIKUFSDJB-ZETCQYMHSA-N |
Product Overview
3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone (CAS 49598-85-8), with molecular formula C10H10O4 and molecular weight 194.06 g/mol. IUPAC: (3S)-3,6,8-trihydroxy-3,4-dihydro-2H-naphthalen-1-one.
Chemical Property Profile of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone
Property Insights of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone. Following Lipinski's Rule of Five, 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone 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
Frequently Asked Questions
What is the CAS number of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone?
The CAS number of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone is 49598-85-8.
What is the molecular formula of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone?
The molecular formula of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone is C10H10O4.
What is the molecular weight of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone?
The molecular weight of 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone is 194.06 g/mol.
Where can I buy 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone?
You can request a quote for 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-3,6,8-trihydoroxy-1(2H)-napthalenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.