2-(Methylthio)thiophene-3-carboxaldehyde
TL;DR: 2-(Methylthio)thiophene-3-carboxaldehyde (CAS 76834-95-2) is a chemical compound with molecular formula C6H6OS2 and molecular weight 157.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylthiophene-3-carbaldehyde
Also Known As: 2-(methylthio)thiophene-3-carboxaldehyde, 2-methylsulfanylthiophene-3-carbaldehyde, 2-(Methylthio)thiophene-3-carbaldehyde, 2-(methylsulfanyl)thiophene-3-carbaldehyde, 2-methylsulfanyl-thiophene-3-carbaldehyde
| Molecular Formula | C6H6OS2 |
|---|---|
| Molecular Weight | 157.99 g/mol |
| LogP | 2.2825 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.98601 |
| Heavy Atoms | 9 |
| Complexity | 204.57771 |
Chemical Identifiers
| CAS Number | 76834-95-2 |
|---|---|
| SMILES | CSC1=C(C=CS1)C=O |
Product Overview
2-(Methylthio)thiophene-3-carboxaldehyde (CAS 76834-95-2), with molecular formula C6H6OS2 and molecular weight 157.99 g/mol. IUPAC: 2-methylsulfanylthiophene-3-carbaldehyde.
Chemical Property Profile of 2-(Methylthio)thiophene-3-carboxaldehyde
Property Insights of 2-(Methylthio)thiophene-3-carboxaldehyde
The XLogP value of 2.2825 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylthio)thiophene-3-carboxaldehyde. With a topological polar surface area (TPSA) of 17.07 Ų, 2-(Methylthio)thiophene-3-carboxaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylthio)thiophene-3-carboxaldehyde has 0 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-(Methylthio)thiophene-3-carboxaldehyde?
The CAS number of 2-(Methylthio)thiophene-3-carboxaldehyde is 76834-95-2.
What is the molecular formula of 2-(Methylthio)thiophene-3-carboxaldehyde?
The molecular formula of 2-(Methylthio)thiophene-3-carboxaldehyde is C6H6OS2.
What is the molecular weight of 2-(Methylthio)thiophene-3-carboxaldehyde?
The molecular weight of 2-(Methylthio)thiophene-3-carboxaldehyde is 157.99 g/mol.
Where can I buy 2-(Methylthio)thiophene-3-carboxaldehyde?
You can request a quote for 2-(Methylthio)thiophene-3-carboxaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylthio)thiophene-3-carboxaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylthio)thiophene-3-carboxaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.