3-nitrothiophene-2-carboxylic Acid
TL;DR: 3-nitrothiophene-2-carboxylic Acid (CAS 89283-80-7) is a chemical compound with molecular formula C5H3NO4S and molecular weight 172.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitrothiophene-2-carboxylic acid
Also Known As: 3-nitrothiophene-2-carboxylic Acid, nitrothiophenecarboxylic, 3-nitrothiophene-2-carboxylicAcid, RefChem:281382
| Molecular Formula | C5H3NO4S |
|---|---|
| Molecular Weight | 172.98 g/mol |
| LogP | 1.3545 |
| Topological Polar Surface Area | 80.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 172.97827 |
| Heavy Atoms | 11 |
| Complexity | 276.686 |
Chemical Identifiers
| CAS Number | 89283-80-7 |
|---|---|
| SMILES | C1=CSC(=C1[N+](=O)[O-])C(=O)O |
Product Overview
3-nitrothiophene-2-carboxylic Acid (CAS 89283-80-7), with molecular formula C5H3NO4S and molecular weight 172.98 g/mol. IUPAC: 3-nitrothiophene-2-carboxylic acid.
Chemical Property Profile of 3-nitrothiophene-2-carboxylic Acid
Property Insights of 3-nitrothiophene-2-carboxylic Acid
The XLogP value of 1.3545 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-nitrothiophene-2-carboxylic Acid. The TPSA of 80.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-nitrothiophene-2-carboxylic Acid. Following Lipinski's Rule of Five, 3-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-nitrothiophene-2-carboxylic Acid?
The CAS number of 3-nitrothiophene-2-carboxylic Acid is 89283-80-7.
What is the molecular formula of 3-nitrothiophene-2-carboxylic Acid?
The molecular formula of 3-nitrothiophene-2-carboxylic Acid is C5H3NO4S.
What is the molecular weight of 3-nitrothiophene-2-carboxylic Acid?
The molecular weight of 3-nitrothiophene-2-carboxylic Acid is 172.98 g/mol.
Where can I buy 3-nitrothiophene-2-carboxylic Acid?
You can request a quote for 3-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-nitrothiophene-2-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-nitrothiophene-2-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.