10-Acetyl dithranol
TL;DR: 10-Acetyl dithranol (CAS 3022-61-5) is a chemical compound with molecular formula C16H12O4 and molecular weight 268.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-acetyl-1,8-dihydroxy-10H-anthracen-9-one
Also Known As: 10-Acetyl dithranol, 10-Acetylanthraline, Dithranol Impurity 4, 1,8-Dihydroxy-10-acetylanthrone, 1,8-dihydroxy-10-acetyl anthrone
| Molecular Formula | C16H12O4 |
|---|---|
| Molecular Weight | 268.07 g/mol |
| LogP | 2.3631 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 268.07355 |
| Heavy Atoms | 20 |
| Complexity | 690.63727 |
Chemical Identifiers
| CAS Number | 3022-61-5 |
|---|---|
| SMILES | CC(=O)C1C2=C(C(=CC=C2)O)C(=O)C3=C1C=CC=C3O |
Product Overview
10-Acetyl dithranol (CAS 3022-61-5), with molecular formula C16H12O4 and molecular weight 268.07 g/mol. IUPAC: 10-acetyl-1,8-dihydroxy-10H-anthracen-9-one.
Chemical Property Profile of 10-Acetyl dithranol
Property Insights of 10-Acetyl dithranol
The XLogP value of 2.3631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10-Acetyl dithranol. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 10-Acetyl dithranol. Following Lipinski's Rule of Five, 10-Acetyl dithranol 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 10-Acetyl dithranol?
The CAS number of 10-Acetyl dithranol is 3022-61-5.
What is the molecular formula of 10-Acetyl dithranol?
The molecular formula of 10-Acetyl dithranol is C16H12O4.
What is the molecular weight of 10-Acetyl dithranol?
The molecular weight of 10-Acetyl dithranol is 268.07 g/mol.
Where can I buy 10-Acetyl dithranol?
You can request a quote for 10-Acetyl dithranol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-Acetyl dithranol?
Yes, KEHONG BIO provides custom synthesis services for 10-Acetyl dithranol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.