1-Nitro-2-naphthoic acid
TL;DR: 1-Nitro-2-naphthoic acid (CAS 103987-83-3) is a chemical compound with molecular formula C11H7NO4 and molecular weight 217.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitronaphthalene-2-carboxylic acid
Also Known As: 1-Nitro-2-naphthoic acid, 1-Nitronaphthalene-2-carboxylic acid, 1-Nitro-2-naphthoicacid, 2-Naphthoic acid, 1-nitro-, 1-nitro-[2]naphthoic acid
| Molecular Formula | C11H7NO4 |
|---|---|
| Molecular Weight | 217.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.0375 |
| Heavy Atoms | 16 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 103987-83-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC(=C2[N+](=O)[O-])C(=O)O |
| InChIKey | RMWJWWYYJRAOMD-UHFFFAOYSA-N |
Product Overview
1-Nitro-2-naphthoic acid (CAS 103987-83-3), with molecular formula C11H7NO4 and molecular weight 217.04 g/mol. IUPAC: 1-nitronaphthalene-2-carboxylic acid.
Chemical Property Profile of 1-Nitro-2-naphthoic acid
Property Insights of 1-Nitro-2-naphthoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Nitro-2-naphthoic acid. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Nitro-2-naphthoic acid. Following Lipinski's Rule of Five, 1-Nitro-2-naphthoic acid has 1 hydrogen bond donor(s) and 4 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 1-Nitro-2-naphthoic acid?
The CAS number of 1-Nitro-2-naphthoic acid is 103987-83-3.
What is the molecular formula of 1-Nitro-2-naphthoic acid?
The molecular formula of 1-Nitro-2-naphthoic acid is C11H7NO4.
What is the molecular weight of 1-Nitro-2-naphthoic acid?
The molecular weight of 1-Nitro-2-naphthoic acid is 217.04 g/mol.
Where can I buy 1-Nitro-2-naphthoic acid?
You can request a quote for 1-Nitro-2-naphthoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitro-2-naphthoic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitro-2-naphthoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.