![4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid structure](/static/products/3596/359618-41-0.webp)
4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid
TL;DR: 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid (CAS 359618-41-0) is a chemical compound with molecular formula C13H8ClNO5 and molecular weight 293.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid
Also Known As: 4-chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid, 4-CHLORO-3-{5-[(E)-2-NITROVINYL]-2-FURYL}BENZOIC ACID, 4-chloro-3-[5-(2-nitrovinyl)-2-furyl]benzoic acid, 4-chloro-3-[5-(2-nitroethenyl)-2-furyl]benzoic Acid, 4-Chloro-3-[5-(2-nitroethen-1-yl)furan-2-yl]benzoic acid
| Molecular Formula | C13H8ClNO5 |
|---|---|
| Molecular Weight | 293.01 g/mol |
| LogP | 3.5456 |
| Topological Polar Surface Area | 93.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 293.0091 |
| Heavy Atoms | 20 |
| Complexity | 704.5371 |
Chemical Identifiers
| CAS Number | 359618-41-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1C(=O)O)C2=CC=C(O2)C=C[N+](=O)[O-])Cl |
Product Overview
4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid (CAS 359618-41-0), with molecular formula C13H8ClNO5 and molecular weight 293.01 g/mol. IUPAC: 4-chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid.
Chemical Property Profile of 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid
Property Insights of 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid
The XLogP value of 3.5456 indicates that 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid. Following Lipinski's Rule of Five, 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic 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 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid?
The CAS number of 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid is 359618-41-0.
What is the molecular formula of 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid?
The molecular formula of 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid is C13H8ClNO5.
What is the molecular weight of 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid?
The molecular weight of 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid is 293.01 g/mol.
Where can I buy 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid?
You can request a quote for 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3-[5-(2-nitroethenyl)furan-2-yl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.