2,2-dihydroxy-1H-phenalene-1,3(2H)-dione
TL;DR: 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione (CAS 18931-20-9) is a chemical compound with molecular formula C13H8O4 and molecular weight 228.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dihydroxyphenalene-1,3-dione
Also Known As: 2,2-dihydroxyphenalene-1,3-dione, 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione, 1H-Phenalene-1,3(2H)-dione, 2,2-dihydroxy-, 2,2-dihydroxy-phenalene-1,3-dione, AE-641/01116044
| Molecular Formula | C13H8O4 |
|---|---|
| Molecular Weight | 228.04 g/mol |
| LogP | 0.8997 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 228.04225 |
| Heavy Atoms | 17 |
| Complexity | 617.4238 |
Chemical Identifiers
| CAS Number | 18931-20-9 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C(=O)C(C(=O)C3=CC=C2)(O)O |
Product Overview
2,2-dihydroxy-1H-phenalene-1,3(2H)-dione (CAS 18931-20-9), with molecular formula C13H8O4 and molecular weight 228.04 g/mol. IUPAC: 2,2-dihydroxyphenalene-1,3-dione.
Chemical Property Profile of 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione
Property Insights of 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione
The XLogP value of 0.8997 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione. Following Lipinski's Rule of Five, 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione has 2 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 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione?
The CAS number of 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione is 18931-20-9.
What is the molecular formula of 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione?
The molecular formula of 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione is C13H8O4.
What is the molecular weight of 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione?
The molecular weight of 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione is 228.04 g/mol.
Where can I buy 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione?
You can request a quote for 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 2,2-dihydroxy-1H-phenalene-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.