Benzoic acid, 2,6-dinitro-
TL;DR: Benzoic acid, 2,6-dinitro- (CAS 603-12-3) is a chemical compound with molecular formula C7H4N2O6 and molecular weight 212.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dinitrobenzoic acid
Also Known As: 2,6-Dinitrobenzoic acid, Benzoic acid, 2,6-dinitro-, Benzoic acid,2,6-dinitro-, 2,6-DINITROBENZOICACID, 2 pound not6-Dinitrobenzoic Acid
| Molecular Formula | C7H4N2O6 |
|---|---|
| Molecular Weight | 212.01 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.00694 |
| Heavy Atoms | 15 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 603-12-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)[N+](=O)[O-])C(=O)O)[N+](=O)[O-] |
| InChIKey | HKKWSIQQYJTJLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 2,6-dinitro- (CAS 603-12-3), with molecular formula C7H4N2O6 and molecular weight 212.01 g/mol. IUPAC: 2,6-dinitrobenzoic acid.
Chemical Property Profile of Benzoic acid, 2,6-dinitro-
Property Insights of Benzoic acid, 2,6-dinitro-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 2,6-dinitro-. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 2,6-dinitro-. Following Lipinski's Rule of Five, Benzoic acid, 2,6-dinitro- 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 Benzoic acid, 2,6-dinitro-?
The CAS number of Benzoic acid, 2,6-dinitro- is 603-12-3.
What is the molecular formula of Benzoic acid, 2,6-dinitro-?
The molecular formula of Benzoic acid, 2,6-dinitro- is C7H4N2O6.
What is the molecular weight of Benzoic acid, 2,6-dinitro-?
The molecular weight of Benzoic acid, 2,6-dinitro- is 212.01 g/mol.
Where can I buy Benzoic acid, 2,6-dinitro-?
You can request a quote for Benzoic acid, 2,6-dinitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2,6-dinitro-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2,6-dinitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.