2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid
TL;DR: 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid (CAS 43046-97-5) is a chemical compound with molecular formula C14H9NO6 and molecular weight 287.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-hydroxy-3-nitrobenzoyl)benzoic acid
Also Known As: 2-(4-hydroxy-3-nitrobenzoyl)benzoic acid, o-(4-Hydroxy-3-nitrobenzoyl)benzoic acid, 2-(4-hydroxy-3-nitro-benzoyl)benzoic acid, 2-[(4-hydroxy-3-nitrophenyl)carbonyl]benzoic acid, 5,5'-difluoro-2,2',4,4'-tetrahydroxybenzophenone
| Molecular Formula | C14H9NO6 |
|---|---|
| Molecular Weight | 287.04 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.043 |
| Heavy Atoms | 21 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 43046-97-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-])C(=O)O |
| InChIKey | XWJQPRPADMOWSK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid (CAS 43046-97-5), with molecular formula C14H9NO6 and molecular weight 287.04 g/mol. IUPAC: 2-(4-hydroxy-3-nitrobenzoyl)benzoic acid.
Chemical Property Profile of 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid
Property Insights of 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid. Following Lipinski's Rule of Five, 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid has 2 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 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid?
The CAS number of 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid is 43046-97-5.
What is the molecular formula of 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid?
The molecular formula of 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid is C14H9NO6.
What is the molecular weight of 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid?
The molecular weight of 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid is 287.04 g/mol.
Where can I buy 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid?
You can request a quote for 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Hydroxy-3-nitrobenzoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.