4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid
TL;DR: 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid (CAS 69960-34-5) is a chemical compound with molecular formula C18H14O6 and molecular weight 326.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,4-dihydroxy-9,10-dioxoanthracen-2-yl)butanoic acid
Also Known As: 4-(1,4-dihydroxy-9,10-dioxoanthracen-2-yl)butanoic acid, 4-(1,4-dihydroxy-9,10-dioxo-anthracen-2-yl)butanoic acid, 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid
| Molecular Formula | C18H14O6 |
|---|---|
| Molecular Weight | 326.08 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 326.07904 |
| Heavy Atoms | 24 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 69960-34-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C=C(C(=C3C2=O)O)CCCC(=O)O)O |
| InChIKey | QQTXZYROFMJPDU-UHFFFAOYSA-N |
Product Overview
4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid (CAS 69960-34-5), with molecular formula C18H14O6 and molecular weight 326.08 g/mol. IUPAC: 4-(1,4-dihydroxy-9,10-dioxoanthracen-2-yl)butanoic acid.
Chemical Property Profile of 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid
Property Insights of 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid
The XLogP value of 3.4 indicates that 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid. Following Lipinski's Rule of Five, 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid has 3 hydrogen bond donor(s) and 6 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 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid?
The CAS number of 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid is 69960-34-5.
What is the molecular formula of 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid?
The molecular formula of 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid is C18H14O6.
What is the molecular weight of 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid?
The molecular weight of 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid is 326.08 g/mol.
Where can I buy 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid?
You can request a quote for 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(1,4-Dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.