1-Nitroanthraquinone
TL;DR: 1-Nitroanthraquinone (CAS 82-34-8) is a chemical compound with molecular formula C14H7NO4 and molecular weight 253.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitroanthracene-9,10-dione
Also Known As: 1-NITROANTHRAQUINONE, 1-nitroanthracene-9,10-dione, 1-Nitroanthrachinon, 1-Nitro-anthraquinone, Not Available
| Molecular Formula | C14H7NO4 |
|---|---|
| Molecular Weight | 253.04 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 253.0375 |
| Heavy Atoms | 19 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 82-34-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-] |
| InChIKey | YCANAXVBJKNANM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Nitroanthraquinone (CAS 82-34-8), with molecular formula C14H7NO4 and molecular weight 253.04 g/mol. IUPAC: 1-nitroanthracene-9,10-dione.
Chemical Property Profile of 1-Nitroanthraquinone
Property Insights of 1-Nitroanthraquinone
The XLogP value of 3.2 indicates that 1-Nitroanthraquinone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Nitroanthraquinone. Following Lipinski's Rule of Five, 1-Nitroanthraquinone has 0 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 1-Nitroanthraquinone?
The CAS number of 1-Nitroanthraquinone is 82-34-8.
What is the molecular formula of 1-Nitroanthraquinone?
The molecular formula of 1-Nitroanthraquinone is C14H7NO4.
What is the molecular weight of 1-Nitroanthraquinone?
The molecular weight of 1-Nitroanthraquinone is 253.04 g/mol.
Where can I buy 1-Nitroanthraquinone?
You can request a quote for 1-Nitroanthraquinone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitroanthraquinone?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitroanthraquinone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.