Isoquinoline, 3,4-dihydro-3,3-dimethyl-1-(methylthio)-

Base Information

• Chemical Name: Isoquinoline, 3,4-dihydro-3,3-dimethyl-1-(methylthio)-
• CAS No.: 132628-97-8
• Molecular Formula: C12H15NS
• Molecular Weight: 205.324
• DSSTox Substance ID: DTXSID40385964
• Nikkaji Number: J1.130.739F
• Wikidata: Q82179059
• Mol file: 132628-97-8.mol

Synonyms:132628-97-8;3,3-Dimethyl-1-(methylthio)-3,4-dihydroisoquinoline;Isoquinoline, 3,4-dihydro-3,3-dimethyl-1-(methylthio)-;Cambridge id 5511950;SCHEMBL20399385;DTXSID40385964;STL563482;AKOS030513979;SR-01000211075;1-methylthio-3,3-dimethyl-3,4-dihydroisoquinoline;SR-01000211075-1;3,3-dimethyl-1-(methylsulfanyl)-3,4-dihydroisoquinoline

Chemical Property of Isoquinoline, 3,4-dihydro-3,3-dimethyl-1-(methylthio)-

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 205.09252066
• Heavy Atom Count: 14
• Complexity: 245

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(CC2=CC=CC=C2C(=N1)SC)C