2-Hydroxy-5-methoxy-3-nitrobenzoic acid
TL;DR: 2-Hydroxy-5-methoxy-3-nitrobenzoic acid (CAS 2888-01-9) is a chemical compound with molecular formula C8H7NO6 and molecular weight 213.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-methoxy-3-nitrobenzoic acid
Also Known As: 2-hydroxy-5-methoxy-3-nitrobenzoic acid, 2-Hydroxy-5-methoxy-3-nitrobenzoicAcid, 2-Hydroxy-5-methoxy-3-nitro-benzoic acid
| Molecular Formula | C8H7NO6 |
|---|---|
| Molecular Weight | 213.03 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 213.02734 |
| Heavy Atoms | 15 |
| Complexity | 262.0 |
Chemical Identifiers
| CAS Number | 2888-01-9 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1)[N+](=O)[O-])O)C(=O)O |
| InChIKey | DRYWDVOZWVCJEY-UHFFFAOYSA-N |
Product Overview
2-Hydroxy-5-methoxy-3-nitrobenzoic acid (CAS 2888-01-9), with molecular formula C8H7NO6 and molecular weight 213.03 g/mol. IUPAC: 2-hydroxy-5-methoxy-3-nitrobenzoic acid.
Chemical Property Profile of 2-Hydroxy-5-methoxy-3-nitrobenzoic acid
Property Insights of 2-Hydroxy-5-methoxy-3-nitrobenzoic acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxy-5-methoxy-3-nitrobenzoic acid. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-5-methoxy-3-nitrobenzoic acid. Following Lipinski's Rule of Five, 2-Hydroxy-5-methoxy-3-nitrobenzoic 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-Hydroxy-5-methoxy-3-nitrobenzoic acid?
The CAS number of 2-Hydroxy-5-methoxy-3-nitrobenzoic acid is 2888-01-9.
What is the molecular formula of 2-Hydroxy-5-methoxy-3-nitrobenzoic acid?
The molecular formula of 2-Hydroxy-5-methoxy-3-nitrobenzoic acid is C8H7NO6.
What is the molecular weight of 2-Hydroxy-5-methoxy-3-nitrobenzoic acid?
The molecular weight of 2-Hydroxy-5-methoxy-3-nitrobenzoic acid is 213.03 g/mol.
Where can I buy 2-Hydroxy-5-methoxy-3-nitrobenzoic acid?
You can request a quote for 2-Hydroxy-5-methoxy-3-nitrobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-5-methoxy-3-nitrobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-5-methoxy-3-nitrobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.