2-chlorothiophene-3-carboxylic Acid
TL;DR: 2-chlorothiophene-3-carboxylic Acid (CAS 59337-81-4) is a chemical compound with molecular formula C5H3ClO2S and molecular weight 161.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chlorothiophene-3-carboxylic acid
Also Known As: 2-chlorothiophene-3-carboxylic Acid, 2-chloro-3-thiophenecarboxylic acid, Rivaroxaban Impurity 22, Rivaroxaban Impurity 135, 3-Thiophenecarboxylic acid, 2-chloro-
| Molecular Formula | C5H3ClO2S |
|---|---|
| Molecular Weight | 161.95 g/mol |
| LogP | 2.0997 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.95422 |
| Heavy Atoms | 9 |
| Complexity | 230.61679 |
Chemical Identifiers
| CAS Number | 59337-81-4 |
|---|---|
| SMILES | C1=CSC(=C1C(=O)O)Cl |
Product Overview
2-chlorothiophene-3-carboxylic Acid (CAS 59337-81-4), with molecular formula C5H3ClO2S and molecular weight 161.95 g/mol. IUPAC: 2-chlorothiophene-3-carboxylic acid.
Chemical Property Profile of 2-chlorothiophene-3-carboxylic Acid
Property Insights of 2-chlorothiophene-3-carboxylic Acid
The XLogP value of 2.0997 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chlorothiophene-3-carboxylic Acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-chlorothiophene-3-carboxylic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chlorothiophene-3-carboxylic Acid has 1 hydrogen bond donor(s) and 2 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-chlorothiophene-3-carboxylic Acid?
The CAS number of 2-chlorothiophene-3-carboxylic Acid is 59337-81-4.
What is the molecular formula of 2-chlorothiophene-3-carboxylic Acid?
The molecular formula of 2-chlorothiophene-3-carboxylic Acid is C5H3ClO2S.
What is the molecular weight of 2-chlorothiophene-3-carboxylic Acid?
The molecular weight of 2-chlorothiophene-3-carboxylic Acid is 161.95 g/mol.
Where can I buy 2-chlorothiophene-3-carboxylic Acid?
You can request a quote for 2-chlorothiophene-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-chlorothiophene-3-carboxylic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-chlorothiophene-3-carboxylic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.