9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-
TL;DR: 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- (CAS 128-91-6) is a chemical compound with molecular formula C14H6N2O8 and molecular weight 330.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dihydroxy-4,8-dinitroanthracene-9,10-dione
Also Known As: 1,5-Dihydroxy-4,8-dinitroanthraquinone, 4,8-Dinitroanthrarufin, Anthrarufin, 4,8-dinitro-, Anthrarufin,8-dinitro-, 4,5-dinitroanthraquinone
| Molecular Formula | C14H6N2O8 |
|---|---|
| Molecular Weight | 330.01 g/mol |
| LogP | 1.6896 |
| Topological Polar Surface Area | 160.88 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.01242 |
| Heavy Atoms | 24 |
| Complexity | 899.7251 |
Chemical Identifiers
| CAS Number | 128-91-6 |
|---|---|
| SMILES | C1=CC(=C2C(=C1[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)[N+](=O)[O-])O)O |
Product Overview
9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- (CAS 128-91-6), with molecular formula C14H6N2O8 and molecular weight 330.01 g/mol. IUPAC: 1,5-dihydroxy-4,8-dinitroanthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-
Property Insights of 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-
The XLogP value of 1.6896 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-. The TPSA of 160.88 Ų indicates high polarity, suggesting 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- has 2 hydrogen bond donor(s) and 8 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 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-?
The CAS number of 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- is 128-91-6.
What is the molecular formula of 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-?
The molecular formula of 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- is C14H6N2O8.
What is the molecular weight of 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-?
The molecular weight of 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- is 330.01 g/mol.
Where can I buy 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-?
You can request a quote for 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1,5-dihydroxy-4,8-dinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.