2-(Naphthylamino)-5-nitrobenzoic acid
TL;DR: 2-(Naphthylamino)-5-nitrobenzoic acid (CAS 62086-52-6) is a chemical compound with molecular formula C17H12N2O4 and molecular weight 308.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(naphthalen-1-ylamino)-5-nitrobenzoic acid
Also Known As: 2-(1-Naphthylamino)-5-nitrobenzoic acid, 2-(naphthylamino)-5-nitrobenzoic acid, 2-(naphthalen-1-ylamino)-5-nitrobenzoic acid, 2-[(1-Naphthyl)amino]-5-nitrobenzoic acid, 2-[(naphthalen-1-yl)amino]-5-nitrobenzoic acid
| Molecular Formula | C17H12N2O4 |
|---|---|
| Molecular Weight | 308.08 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 308.0797 |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 62086-52-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2NC3=C(C=C(C=C3)[N+](=O)[O-])C(=O)O |
| InChIKey | SIKRUWBIRMQZCG-UHFFFAOYSA-N |
Product Overview
2-(Naphthylamino)-5-nitrobenzoic acid (CAS 62086-52-6), with molecular formula C17H12N2O4 and molecular weight 308.08 g/mol. IUPAC: 2-(naphthalen-1-ylamino)-5-nitrobenzoic acid.
Chemical Property Profile of 2-(Naphthylamino)-5-nitrobenzoic acid
Property Insights of 2-(Naphthylamino)-5-nitrobenzoic acid
The XLogP value of 5.8 indicates that 2-(Naphthylamino)-5-nitrobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Naphthylamino)-5-nitrobenzoic acid. Following Lipinski's Rule of Five, 2-(Naphthylamino)-5-nitrobenzoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(Naphthylamino)-5-nitrobenzoic acid?
The CAS number of 2-(Naphthylamino)-5-nitrobenzoic acid is 62086-52-6.
What is the molecular formula of 2-(Naphthylamino)-5-nitrobenzoic acid?
The molecular formula of 2-(Naphthylamino)-5-nitrobenzoic acid is C17H12N2O4.
What is the molecular weight of 2-(Naphthylamino)-5-nitrobenzoic acid?
The molecular weight of 2-(Naphthylamino)-5-nitrobenzoic acid is 308.08 g/mol.
Where can I buy 2-(Naphthylamino)-5-nitrobenzoic acid?
You can request a quote for 2-(Naphthylamino)-5-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-(Naphthylamino)-5-nitrobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Naphthylamino)-5-nitrobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.