3-Bromo-5-nitrothiophene-2-carboxylic acid
TL;DR: 3-Bromo-5-nitrothiophene-2-carboxylic acid (CAS 89283-23-8) is a chemical compound with molecular formula C5H2BrNO4S and molecular weight 250.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-5-nitrothiophene-2-carboxylic acid
Also Known As: 3-bromo-5-nitrothiophene-2-carboxylic acid, 3-bromo-5-nitro-2-thiophenecarboxylic acid, AI-942/25121014
| Molecular Formula | C5H2BrNO4S |
|---|---|
| Molecular Weight | 250.89 g/mol |
| LogP | 2.117 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.8888 |
| Heavy Atoms | 12 |
| Complexity | 347.21747 |
Chemical Identifiers
| CAS Number | 89283-23-8 |
|---|---|
| SMILES | C1=C(SC(=C1Br)C(=O)O)[N+](=O)[O-] |
Product Overview
3-Bromo-5-nitrothiophene-2-carboxylic acid (CAS 89283-23-8), with molecular formula C5H2BrNO4S and molecular weight 250.89 g/mol. IUPAC: 3-bromo-5-nitrothiophene-2-carboxylic acid.
Chemical Property Profile of 3-Bromo-5-nitrothiophene-2-carboxylic acid
Property Insights of 3-Bromo-5-nitrothiophene-2-carboxylic acid
The XLogP value of 2.117 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Bromo-5-nitrothiophene-2-carboxylic acid. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Bromo-5-nitrothiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 3-Bromo-5-nitrothiophene-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 3-Bromo-5-nitrothiophene-2-carboxylic acid?
The CAS number of 3-Bromo-5-nitrothiophene-2-carboxylic acid is 89283-23-8.
What is the molecular formula of 3-Bromo-5-nitrothiophene-2-carboxylic acid?
The molecular formula of 3-Bromo-5-nitrothiophene-2-carboxylic acid is C5H2BrNO4S.
What is the molecular weight of 3-Bromo-5-nitrothiophene-2-carboxylic acid?
The molecular weight of 3-Bromo-5-nitrothiophene-2-carboxylic acid is 250.89 g/mol.
Where can I buy 3-Bromo-5-nitrothiophene-2-carboxylic acid?
You can request a quote for 3-Bromo-5-nitrothiophene-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 3-Bromo-5-nitrothiophene-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-5-nitrothiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.