3-Nitro-5-sulphosalicylic acid
TL;DR: 3-Nitro-5-sulphosalicylic acid (CAS 56609-17-7) is a chemical compound with molecular formula C7H5NO8S and molecular weight 262.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-3-nitro-5-sulfobenzoic acid
Also Known As: 3-Nitro-5-sulphosalicylic acid, 2-hydroxy-3-nitro-5-sulfobenzoic acid, 3-nitro-5-sulphosalicylicacid, 3-nitro-5-sulfosalicylic acid, Benzoic acid,2-hydroxy-3-nitro-5-sulfo-
| Molecular Formula | C7H5NO8S |
|---|---|
| Molecular Weight | 262.97 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 166.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.9736 |
| Heavy Atoms | 17 |
| Complexity | 420.0 |
Chemical Identifiers
| CAS Number | 56609-17-7 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)O)[N+](=O)[O-])S(=O)(=O)O |
| InChIKey | ULEVDAVOVJCFSJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Nitro-5-sulphosalicylic acid (CAS 56609-17-7), with molecular formula C7H5NO8S and molecular weight 262.97 g/mol. IUPAC: 2-hydroxy-3-nitro-5-sulfobenzoic acid.
Chemical Property Profile of 3-Nitro-5-sulphosalicylic acid
Property Insights of 3-Nitro-5-sulphosalicylic acid
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Nitro-5-sulphosalicylic acid. The TPSA of 166.0 Ų indicates high polarity, suggesting 3-Nitro-5-sulphosalicylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-Nitro-5-sulphosalicylic acid has 3 hydrogen bond donor(s) and 8 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 3-Nitro-5-sulphosalicylic acid?
The CAS number of 3-Nitro-5-sulphosalicylic acid is 56609-17-7.
What is the molecular formula of 3-Nitro-5-sulphosalicylic acid?
The molecular formula of 3-Nitro-5-sulphosalicylic acid is C7H5NO8S.
What is the molecular weight of 3-Nitro-5-sulphosalicylic acid?
The molecular weight of 3-Nitro-5-sulphosalicylic acid is 262.97 g/mol.
Where can I buy 3-Nitro-5-sulphosalicylic acid?
You can request a quote for 3-Nitro-5-sulphosalicylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Nitro-5-sulphosalicylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Nitro-5-sulphosalicylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.