2-(3-Nitroanilino)-2-oxoacetic acid
TL;DR: 2-(3-Nitroanilino)-2-oxoacetic acid (CAS 67923-65-3) is a chemical compound with molecular formula C8H6N2O5 and molecular weight 210.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-nitroanilino)-2-oxoacetic acid
Also Known As: 3-Nitro-oxanilsaeure, 2-(3-nitroanilino)-2-oxoacetic acid, [(3-nitrophenyl)amino](oxo)acetic acid, (3-Nitroanilino)(oxo)acetic acid, KST-1A7460
| Molecular Formula | C8H6N2O5 |
|---|---|
| Molecular Weight | 210.03 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.02766 |
| Heavy Atoms | 15 |
| Complexity | 285.0 |
Chemical Identifiers
| CAS Number | 67923-65-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)C(=O)O |
| InChIKey | CROYMQQHSFRWHS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(3-Nitroanilino)-2-oxoacetic acid (CAS 67923-65-3), with molecular formula C8H6N2O5 and molecular weight 210.03 g/mol. IUPAC: 2-(3-nitroanilino)-2-oxoacetic acid.
Chemical Property Profile of 2-(3-Nitroanilino)-2-oxoacetic acid
Property Insights of 2-(3-Nitroanilino)-2-oxoacetic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Nitroanilino)-2-oxoacetic acid. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Nitroanilino)-2-oxoacetic acid. Following Lipinski's Rule of Five, 2-(3-Nitroanilino)-2-oxoacetic acid has 2 hydrogen bond donor(s) and 5 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 2-(3-Nitroanilino)-2-oxoacetic acid?
The CAS number of 2-(3-Nitroanilino)-2-oxoacetic acid is 67923-65-3.
What is the molecular formula of 2-(3-Nitroanilino)-2-oxoacetic acid?
The molecular formula of 2-(3-Nitroanilino)-2-oxoacetic acid is C8H6N2O5.
What is the molecular weight of 2-(3-Nitroanilino)-2-oxoacetic acid?
The molecular weight of 2-(3-Nitroanilino)-2-oxoacetic acid is 210.03 g/mol.
Where can I buy 2-(3-Nitroanilino)-2-oxoacetic acid?
You can request a quote for 2-(3-Nitroanilino)-2-oxoacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-Nitroanilino)-2-oxoacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-Nitroanilino)-2-oxoacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.