Phenyl 1-hydroxy-4-nitro-2-naphthoate
TL;DR: Phenyl 1-hydroxy-4-nitro-2-naphthoate (CAS 65208-34-6) is a chemical compound with molecular formula C17H11NO5 and molecular weight 309.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl 1-hydroxy-4-nitronaphthalene-2-carboxylate
Also Known As: Phenyl 1-hydroxy-4-nitro-2-naphthoate, phenyl1-hydroxy-4-nitro-2-naphthoate, phenyl 1-hydroxy-4-nitronaphthalene-2-carboxylate, 2-Naphthalenecarboxylic acid, 1-hydroxy-4-nitro-, phenyl ester, 4-nitro-2-phenoxycarbonyl-1-naphthol
| Molecular Formula | C17H11NO5 |
|---|---|
| Molecular Weight | 309.06 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 309.06372 |
| Heavy Atoms | 23 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 65208-34-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC(=O)C2=C(C3=CC=CC=C3C(=C2)[N+](=O)[O-])O |
| InChIKey | DMPUGHYNLCGVPX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenyl 1-hydroxy-4-nitro-2-naphthoate (CAS 65208-34-6), with molecular formula C17H11NO5 and molecular weight 309.06 g/mol. IUPAC: phenyl 1-hydroxy-4-nitronaphthalene-2-carboxylate.
Chemical Property Profile of Phenyl 1-hydroxy-4-nitro-2-naphthoate
Property Insights of Phenyl 1-hydroxy-4-nitro-2-naphthoate
The XLogP value of 4.6 indicates that Phenyl 1-hydroxy-4-nitro-2-naphthoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenyl 1-hydroxy-4-nitro-2-naphthoate. Following Lipinski's Rule of Five, Phenyl 1-hydroxy-4-nitro-2-naphthoate 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 Phenyl 1-hydroxy-4-nitro-2-naphthoate?
The CAS number of Phenyl 1-hydroxy-4-nitro-2-naphthoate is 65208-34-6.
What is the molecular formula of Phenyl 1-hydroxy-4-nitro-2-naphthoate?
The molecular formula of Phenyl 1-hydroxy-4-nitro-2-naphthoate is C17H11NO5.
What is the molecular weight of Phenyl 1-hydroxy-4-nitro-2-naphthoate?
The molecular weight of Phenyl 1-hydroxy-4-nitro-2-naphthoate is 309.06 g/mol.
Where can I buy Phenyl 1-hydroxy-4-nitro-2-naphthoate?
You can request a quote for Phenyl 1-hydroxy-4-nitro-2-naphthoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl 1-hydroxy-4-nitro-2-naphthoate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl 1-hydroxy-4-nitro-2-naphthoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.