2-Cyanothiophene-3-carboxylic acid
TL;DR: 2-Cyanothiophene-3-carboxylic acid (CAS 71154-34-2) is a chemical compound with molecular formula C6H3NO2S and molecular weight 152.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyanothiophene-3-carboxylic acid
Also Known As: 2-cyanothiophene-3-carboxylic acid, 2-Cyano-3-thioenylcarboxylic acid, 2-Cyanothiophen-3-carbonsaeure, 2-cyanothiophene-3-carboxylicacid, 3-Thiophenecarboxylicacid,2-cyano-(9CI)
| Molecular Formula | C6H3NO2S |
|---|---|
| Molecular Weight | 152.99 g/mol |
| LogP | 1.31798 |
| Topological Polar Surface Area | 61.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 152.98845 |
| Heavy Atoms | 10 |
| Complexity | 296.94162 |
Chemical Identifiers
| CAS Number | 71154-34-2 |
|---|---|
| SMILES | C1=CSC(=C1C(=O)O)C#N |
Product Overview
2-Cyanothiophene-3-carboxylic acid (CAS 71154-34-2), with molecular formula C6H3NO2S and molecular weight 152.99 g/mol. IUPAC: 2-cyanothiophene-3-carboxylic acid.
Chemical Property Profile of 2-Cyanothiophene-3-carboxylic acid
Property Insights of 2-Cyanothiophene-3-carboxylic acid
The XLogP value of 1.31798 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyanothiophene-3-carboxylic acid. The TPSA of 61.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyanothiophene-3-carboxylic acid. Following Lipinski's Rule of Five, 2-Cyanothiophene-3-carboxylic acid has 1 hydrogen bond donor(s) and 3 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-Cyanothiophene-3-carboxylic acid?
The CAS number of 2-Cyanothiophene-3-carboxylic acid is 71154-34-2.
What is the molecular formula of 2-Cyanothiophene-3-carboxylic acid?
The molecular formula of 2-Cyanothiophene-3-carboxylic acid is C6H3NO2S.
What is the molecular weight of 2-Cyanothiophene-3-carboxylic acid?
The molecular weight of 2-Cyanothiophene-3-carboxylic acid is 152.99 g/mol.
Where can I buy 2-Cyanothiophene-3-carboxylic acid?
You can request a quote for 2-Cyanothiophene-3-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Cyanothiophene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyanothiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.