4-(2,6-Dimethyl-4-sulfanyl-3-quinolyl)butan-2-one

Base Information

• Chemical Name: 4-(2,6-Dimethyl-4-sulfanyl-3-quinolyl)butan-2-one
• CAS No.: 5687-27-4
• Molecular Formula: C15H17NOS
• Molecular Weight: 259.3666
• DSSTox Substance ID: DTXSID60972294
• Mol file: 5687-27-4.mol

Synonyms:4-(2,6-dimethyl-4-sulfanyl-3-quinolyl)butan-2-one;5687-27-4;4-(2,6-dimethyl-4-sulfanylquinolin-3-yl)butan-2-one;4-(2,6-dimethyl-4-sulfanylidene-1H-quinolin-3-yl)butan-2-one;DTXSID60972294;WPIXBWCORYNYKV-UHFFFAOYSA-N;STL297665;AKOS000618555;AG-690/40096507;2-Butanone, 4-(2,6-dimethyl-4-mercapto-3-quinolyl)-;4-(2,6-Dimethyl-4-sulfanyl-3-quinolinyl)-2-butanone #;4-(2,6-Dimethyl-4-sulfanylidene-1,4-dihydroquinolin-3-yl)butan-2-one

Chemical Property of 4-(2,6-Dimethyl-4-sulfanyl-3-quinolyl)butan-2-one

Chemical Property:

• Vapor Pressure: 1.65E-06mmHg at 25°C
• Boiling Point: 396.9°Cat760mmHg
• Flash Point: 193.8°C
• Density: 1.17g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 259.10308534
• Heavy Atom Count: 18
• Complexity: 399

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)NC(=C(C2=S)CCC(=O)C)C