1-Nitroanthraquinone-2-carboxylic acid
TL;DR: 1-Nitroanthraquinone-2-carboxylic acid (CAS 128-67-6) is a chemical compound with molecular formula C15H7NO6 and molecular weight 297.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitro-9,10-dioxoanthracene-2-carboxylic acid
Also Known As: 1-Nitro-2-carboxyanthraquinone, L-mimosine, 1-nitro-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid, 9, 1-nitro-, 1-Nitro-2-anthroic acid
| Molecular Formula | C15H7NO6 |
|---|---|
| Molecular Weight | 297.03 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 297.02734 |
| Heavy Atoms | 22 |
| Complexity | 539.0 |
Chemical Identifiers
| CAS Number | 128-67-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)O)[N+](=O)[O-] |
| InChIKey | PMOCDYOEOUEPAN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Nitroanthraquinone-2-carboxylic acid (CAS 128-67-6), with molecular formula C15H7NO6 and molecular weight 297.03 g/mol. IUPAC: 1-nitro-9,10-dioxoanthracene-2-carboxylic acid.
Chemical Property Profile of 1-Nitroanthraquinone-2-carboxylic acid
Property Insights of 1-Nitroanthraquinone-2-carboxylic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Nitroanthraquinone-2-carboxylic acid. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Nitroanthraquinone-2-carboxylic acid. Following Lipinski's Rule of Five, 1-Nitroanthraquinone-2-carboxylic acid has 1 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 1-Nitroanthraquinone-2-carboxylic acid?
The CAS number of 1-Nitroanthraquinone-2-carboxylic acid is 128-67-6.
What is the molecular formula of 1-Nitroanthraquinone-2-carboxylic acid?
The molecular formula of 1-Nitroanthraquinone-2-carboxylic acid is C15H7NO6.
What is the molecular weight of 1-Nitroanthraquinone-2-carboxylic acid?
The molecular weight of 1-Nitroanthraquinone-2-carboxylic acid is 297.03 g/mol.
Where can I buy 1-Nitroanthraquinone-2-carboxylic acid?
You can request a quote for 1-Nitroanthraquinone-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitroanthraquinone-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitroanthraquinone-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.