6-Formyl-2-(methylsulfanyl)nicotinonitrile
TL;DR: 6-Formyl-2-(methylsulfanyl)nicotinonitrile (CAS 175277-27-7) is a chemical compound with molecular formula C8H6N2OS and molecular weight 178.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-formyl-2-methylsulfanylpyridine-3-carbonitrile
Also Known As: n-Hentriacontane, 6-Formyl-2-(methylthio)nicotinonitrile, 6-FORMYL-2-(METHYLSULFANYL)NICOTINONITRILE, 3-Cyano-2-(methylthio)pyridine-6-carboxaldehyde, 6-formyl-2-(methylsulfanyl)pyridine-3-carbonitrile
| Molecular Formula | C8H6N2OS |
|---|---|
| Molecular Weight | 178.02 g/mol |
| LogP | 1.48768 |
| Topological Polar Surface Area | 53.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 178.02008 |
| Heavy Atoms | 12 |
| Complexity | 343.40137 |
Chemical Identifiers
| CAS Number | 175277-27-7 |
|---|---|
| SMILES | CSC1=C(C=CC(=N1)C=O)C#N |
Product Overview
6-Formyl-2-(methylsulfanyl)nicotinonitrile (CAS 175277-27-7), with molecular formula C8H6N2OS and molecular weight 178.02 g/mol. IUPAC: 6-formyl-2-methylsulfanylpyridine-3-carbonitrile.
Chemical Property Profile of 6-Formyl-2-(methylsulfanyl)nicotinonitrile
Property Insights of 6-Formyl-2-(methylsulfanyl)nicotinonitrile
The XLogP value of 1.48768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Formyl-2-(methylsulfanyl)nicotinonitrile. With a topological polar surface area (TPSA) of 53.75 Ų, 6-Formyl-2-(methylsulfanyl)nicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Formyl-2-(methylsulfanyl)nicotinonitrile has 0 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 6-Formyl-2-(methylsulfanyl)nicotinonitrile?
The CAS number of 6-Formyl-2-(methylsulfanyl)nicotinonitrile is 175277-27-7.
What is the molecular formula of 6-Formyl-2-(methylsulfanyl)nicotinonitrile?
The molecular formula of 6-Formyl-2-(methylsulfanyl)nicotinonitrile is C8H6N2OS.
What is the molecular weight of 6-Formyl-2-(methylsulfanyl)nicotinonitrile?
The molecular weight of 6-Formyl-2-(methylsulfanyl)nicotinonitrile is 178.02 g/mol.
Where can I buy 6-Formyl-2-(methylsulfanyl)nicotinonitrile?
You can request a quote for 6-Formyl-2-(methylsulfanyl)nicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Formyl-2-(methylsulfanyl)nicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-Formyl-2-(methylsulfanyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.