5-Nitro-2-naphthalenesulfonic acid
TL;DR: 5-Nitro-2-naphthalenesulfonic acid (CAS 86-69-1) is a chemical compound with molecular formula C10H7NO5S and molecular weight 253.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-nitronaphthalene-2-sulfonic acid
Also Known As: 5-nitro-2-naphthalenesulfonic acid, 1-Nitro-6-naphthalenesulfonic acid, 5-nitronaphthalene-2-sulfonic acid, 5-nitro-2-naphthalene-sulphonic acid, RefChem:304400
| Molecular Formula | C10H7NO5S |
|---|---|
| Molecular Weight | 253.00 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.00449 |
| Heavy Atoms | 17 |
| Complexity | 396.0 |
Chemical Identifiers
| CAS Number | 86-69-1 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=C2)S(=O)(=O)O)C(=C1)[N+](=O)[O-] |
| InChIKey | ZAPHEIOXULZTDR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Nitro-2-naphthalenesulfonic acid (CAS 86-69-1), with molecular formula C10H7NO5S and molecular weight 253.00 g/mol. IUPAC: 5-nitronaphthalene-2-sulfonic acid.
Chemical Property Profile of 5-Nitro-2-naphthalenesulfonic acid
Property Insights of 5-Nitro-2-naphthalenesulfonic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Nitro-2-naphthalenesulfonic acid. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Nitro-2-naphthalenesulfonic acid. Following Lipinski's Rule of Five, 5-Nitro-2-naphthalenesulfonic acid has 1 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 5-Nitro-2-naphthalenesulfonic acid?
The CAS number of 5-Nitro-2-naphthalenesulfonic acid is 86-69-1.
What is the molecular formula of 5-Nitro-2-naphthalenesulfonic acid?
The molecular formula of 5-Nitro-2-naphthalenesulfonic acid is C10H7NO5S.
What is the molecular weight of 5-Nitro-2-naphthalenesulfonic acid?
The molecular weight of 5-Nitro-2-naphthalenesulfonic acid is 253.00 g/mol.
Where can I buy 5-Nitro-2-naphthalenesulfonic acid?
You can request a quote for 5-Nitro-2-naphthalenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Nitro-2-naphthalenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Nitro-2-naphthalenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.