9,10-Anthracenedione, 1-amino-4,5-dinitro-
TL;DR: 9,10-Anthracenedione, 1-amino-4,5-dinitro- (CAS 65059-37-2) is a chemical compound with molecular formula C14H7N3O6 and molecular weight 313.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-amino-4,5-dinitroanthracene-9,10-dione
Also Known As: Anthraquinone, 1-amino-4,5-dinitro-, 9,10-Anthracenedione, 1-amino-4,5-dinitro-, 1-amino-4,5-dinitroanthracene-9,10-dione, 1-Amino-4,5-dinitro-9,10-anthraquinone, 1-AMINO-4,5-DINITRO-9,10-DIHYDROANTHRACENE-9,10-DIONE
| Molecular Formula | C14H7N3O6 |
|---|---|
| Molecular Weight | 313.03 g/mol |
| LogP | 1.8606 |
| Topological Polar Surface Area | 146.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.03348 |
| Heavy Atoms | 23 |
| Complexity | 934.3501 |
Chemical Identifiers
| CAS Number | 65059-37-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)[N+](=O)[O-])C(=O)C3=C(C=CC(=C3C2=O)N)[N+](=O)[O-] |
Product Overview
9,10-Anthracenedione, 1-amino-4,5-dinitro- (CAS 65059-37-2), with molecular formula C14H7N3O6 and molecular weight 313.03 g/mol. IUPAC: 1-amino-4,5-dinitroanthracene-9,10-dione.
Chemical Property Profile of 9,10-Anthracenedione, 1-amino-4,5-dinitro-
Property Insights of 9,10-Anthracenedione, 1-amino-4,5-dinitro-
The XLogP value of 1.8606 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9,10-Anthracenedione, 1-amino-4,5-dinitro-. The TPSA of 146.44 Ų indicates high polarity, suggesting 9,10-Anthracenedione, 1-amino-4,5-dinitro- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9,10-Anthracenedione, 1-amino-4,5-dinitro- has 1 hydrogen bond donor(s) and 7 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-amino-4,5-dinitro-?
The CAS number of 9,10-Anthracenedione, 1-amino-4,5-dinitro- is 65059-37-2.
What is the molecular formula of 9,10-Anthracenedione, 1-amino-4,5-dinitro-?
The molecular formula of 9,10-Anthracenedione, 1-amino-4,5-dinitro- is C14H7N3O6.
What is the molecular weight of 9,10-Anthracenedione, 1-amino-4,5-dinitro-?
The molecular weight of 9,10-Anthracenedione, 1-amino-4,5-dinitro- is 313.03 g/mol.
Where can I buy 9,10-Anthracenedione, 1-amino-4,5-dinitro-?
You can request a quote for 9,10-Anthracenedione, 1-amino-4,5-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-amino-4,5-dinitro-?
Yes, KEHONG BIO provides custom synthesis services for 9,10-Anthracenedione, 1-amino-4,5-dinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.