4-Pyridinecarboxylic acid, 4-nitrophenyl ester
TL;DR: 4-Pyridinecarboxylic acid, 4-nitrophenyl ester (CAS 2882-35-1) is a chemical compound with molecular formula C12H8N2O4 and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) pyridine-4-carboxylate
Also Known As: 4-nitrophenyl isonicotinate, (4-nitrophenyl) pyridine-4-carboxylate, 4-Pyridinecarboxylic acid, 4-nitrophenyl ester, isonicotinic acid 4-nitrophenyl ester, 4-NITROPHENYL PYRIDINE-4-CARBOXYLATE
| Molecular Formula | C12H8N2O4 |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 2.209 |
| Topological Polar Surface Area | 82.33 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 244.0484 |
| Heavy Atoms | 18 |
| Complexity | 566.3911 |
Chemical Identifiers
| CAS Number | 2882-35-1 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC(=O)C2=CC=NC=C2 |
Product Overview
4-Pyridinecarboxylic acid, 4-nitrophenyl ester (CAS 2882-35-1), with molecular formula C12H8N2O4 and molecular weight 244.05 g/mol. IUPAC: (4-nitrophenyl) pyridine-4-carboxylate.
Chemical Property Profile of 4-Pyridinecarboxylic acid, 4-nitrophenyl ester
Property Insights of 4-Pyridinecarboxylic acid, 4-nitrophenyl ester
The XLogP value of 2.209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Pyridinecarboxylic acid, 4-nitrophenyl ester. The TPSA of 82.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pyridinecarboxylic acid, 4-nitrophenyl ester. Following Lipinski's Rule of Five, 4-Pyridinecarboxylic acid, 4-nitrophenyl ester has 0 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 4-Pyridinecarboxylic acid, 4-nitrophenyl ester?
The CAS number of 4-Pyridinecarboxylic acid, 4-nitrophenyl ester is 2882-35-1.
What is the molecular formula of 4-Pyridinecarboxylic acid, 4-nitrophenyl ester?
The molecular formula of 4-Pyridinecarboxylic acid, 4-nitrophenyl ester is C12H8N2O4.
What is the molecular weight of 4-Pyridinecarboxylic acid, 4-nitrophenyl ester?
The molecular weight of 4-Pyridinecarboxylic acid, 4-nitrophenyl ester is 244.05 g/mol.
Where can I buy 4-Pyridinecarboxylic acid, 4-nitrophenyl ester?
You can request a quote for 4-Pyridinecarboxylic acid, 4-nitrophenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pyridinecarboxylic acid, 4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Pyridinecarboxylic acid, 4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.