2-Benzofurancarboxylic acid, 4-nitrophenyl ester
TL;DR: 2-Benzofurancarboxylic acid, 4-nitrophenyl ester (CAS 92424-76-5) is a chemical compound with molecular formula C15H9NO5 and molecular weight 283.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-nitrophenyl) 1-benzofuran-2-carboxylate
Also Known As: 2-Benzofurancarboxylic acid, 4-nitrophenyl ester, Cumarilsaeure-
| Molecular Formula | C15H9NO5 |
|---|---|
| Molecular Weight | 283.05 g/mol |
| LogP | 3.5602 |
| Topological Polar Surface Area | 82.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 283.04807 |
| Heavy Atoms | 21 |
| Complexity | 786.45605 |
Chemical Identifiers
| CAS Number | 92424-76-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C(=O)OC3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
2-Benzofurancarboxylic acid, 4-nitrophenyl ester (CAS 92424-76-5), with molecular formula C15H9NO5 and molecular weight 283.05 g/mol. IUPAC: (4-nitrophenyl) 1-benzofuran-2-carboxylate.
Chemical Property Profile of 2-Benzofurancarboxylic acid, 4-nitrophenyl ester
Property Insights of 2-Benzofurancarboxylic acid, 4-nitrophenyl ester
The XLogP value of 3.5602 indicates that 2-Benzofurancarboxylic acid, 4-nitrophenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzofurancarboxylic acid, 4-nitrophenyl ester. Following Lipinski's Rule of Five, 2-Benzofurancarboxylic 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 2-Benzofurancarboxylic acid, 4-nitrophenyl ester?
The CAS number of 2-Benzofurancarboxylic acid, 4-nitrophenyl ester is 92424-76-5.
What is the molecular formula of 2-Benzofurancarboxylic acid, 4-nitrophenyl ester?
The molecular formula of 2-Benzofurancarboxylic acid, 4-nitrophenyl ester is C15H9NO5.
What is the molecular weight of 2-Benzofurancarboxylic acid, 4-nitrophenyl ester?
The molecular weight of 2-Benzofurancarboxylic acid, 4-nitrophenyl ester is 283.05 g/mol.
Where can I buy 2-Benzofurancarboxylic acid, 4-nitrophenyl ester?
You can request a quote for 2-Benzofurancarboxylic 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 2-Benzofurancarboxylic acid, 4-nitrophenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzofurancarboxylic acid, 4-nitrophenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.