5-(4-Nitrophenyl)thiophene-2-carboxylic acid
TL;DR: 5-(4-Nitrophenyl)thiophene-2-carboxylic acid (CAS 80387-79-7) is a chemical compound with molecular formula C11H7NO4S and molecular weight 249.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(4-nitrophenyl)thiophene-2-carboxylic acid
Also Known As: 5-(4-Nitrophenyl)thiophene-2-carboxylic acid, 5735AH, BAS 00281178, 5-(4-nitrophenyl)-2-thiophenecarboxylic acid, 5-(4-Nitrophenyl)thiophene-2-carboxylicacid
| Molecular Formula | C11H7NO4S |
|---|---|
| Molecular Weight | 249.01 g/mol |
| LogP | 3.0215 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.00958 |
| Heavy Atoms | 17 |
| Complexity | 573.4123 |
Chemical Identifiers
| CAS Number | 80387-79-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CC=C(S2)C(=O)O)[N+](=O)[O-] |
Product Overview
5-(4-Nitrophenyl)thiophene-2-carboxylic acid (CAS 80387-79-7), with molecular formula C11H7NO4S and molecular weight 249.01 g/mol. IUPAC: 5-(4-nitrophenyl)thiophene-2-carboxylic acid.
Chemical Property Profile of 5-(4-Nitrophenyl)thiophene-2-carboxylic acid
Property Insights of 5-(4-Nitrophenyl)thiophene-2-carboxylic acid
The XLogP value of 3.0215 indicates that 5-(4-Nitrophenyl)thiophene-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-Nitrophenyl)thiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 5-(4-Nitrophenyl)thiophene-2-carboxylic 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 5-(4-Nitrophenyl)thiophene-2-carboxylic acid?
The CAS number of 5-(4-Nitrophenyl)thiophene-2-carboxylic acid is 80387-79-7.
What is the molecular formula of 5-(4-Nitrophenyl)thiophene-2-carboxylic acid?
The molecular formula of 5-(4-Nitrophenyl)thiophene-2-carboxylic acid is C11H7NO4S.
What is the molecular weight of 5-(4-Nitrophenyl)thiophene-2-carboxylic acid?
The molecular weight of 5-(4-Nitrophenyl)thiophene-2-carboxylic acid is 249.01 g/mol.
Where can I buy 5-(4-Nitrophenyl)thiophene-2-carboxylic acid?
You can request a quote for 5-(4-Nitrophenyl)thiophene-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-Nitrophenyl)thiophene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-Nitrophenyl)thiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.