5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile
TL;DR: 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile (CAS 303146-50-1) is a chemical compound with molecular formula C15H12N2OS and molecular weight 268.06705 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-acetyl-6-methyl-2-phenylsulfanylpyridine-3-carbonitrile
Also Known As: 5-acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile, 11K-339S, 5-acetyl-6-methyl-2-phenylsulfanylpyridine-3-carbonitrile, 5-acetyl-6-methyl-2-(phenylsulfanyl)pyridine-3-carbonitrile, 5-acetyl-6-methyl-2-(phenylthio)nicotinonitrile
Technical Specifications
| Molecular Formula | C15H12N2OS |
| Molecular Weight | 268.06705 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 79.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.06705 Da |
| Heavy Atoms | 19 |
| Complexity | 370.0 |
| SMILES | CC1=C(C=C(C(=N1)SC2=CC=CC=C2)C#N)C(=O)C |
| InChIKey | WNANIVUJPCGBCS-UHFFFAOYSA-N |
Product Description
Applications: 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile is a fine chemical identified by CAS number 303146-50-1 and the molecular formula C15H12N2OS and a molecular weight of 268.07 g/mol. Synonyms include KS-00002ZGE and 5-acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile
Property Insights of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile
The XLogP value of 3.1 indicates that 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile. Following Lipinski's Rule of Five, 5-Acetyl-6-methyl-2-(phenylsulfanyl)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
What is the CAS number of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile?
The CAS number of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile is 303146-50-1.
What is the molecular formula of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile?
The molecular formula of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile is C15H12N2OS.
What is the molecular weight of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile?
The molecular weight of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile is 268.06705 g/mol.
What are the applications of 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile?
5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
Where can I buy 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile?
You can request a quote for 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile?
Yes, CoreyChem provides custom synthesis services for 5-Acetyl-6-methyl-2-(phenylsulfanyl)nicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.