6-Methyl-8-beta-(methylthiomethyl)-ergoline hydrochloride

Base Information

• Chemical Name: 6-Methyl-8-beta-(methylthiomethyl)-ergoline hydrochloride
• CAS No.: 111337-90-7
• Molecular Formula: C17H22 N2 S . Cl H
• Molecular Weight: 322.8959
• DSSTox Substance ID: DTXSID00912119

Synonyms:6-Methyl-8-beta-(methylthiomethyl)-ergoline hydrochloride;(8-beta)-6-Methyl-8-((methylthio)methyl)ergoline monohydrochloride;Ergoline, 6-methyl-8-((methylthio)methyl)-, monohydrochloride, (8-beta)-;111337-90-7;DTXSID00912119;LS-64461;6-Methyl-8-[(methylsulfanyl)methyl]ergoline--hydrogen chloride (1/1)

Chemical Property of 6-Methyl-8-beta-(methylthiomethyl)-ergoline hydrochloride

Chemical Property:

• Vapor Pressure: 4.98E-09mmHg at 25°C
• Boiling Point: 470.6°C at 760 mmHg
• Flash Point: 238.4°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 322.1270476
• Heavy Atom Count: 21
• Complexity: 361

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC(CC2C1CC3=CNC4=CC=CC2=C34)CSC.Cl
• Isomeric SMILES: CN1C[C@@H](CC2[C@H]1CC3=CNC4=CC=CC2=C34)CSC.Cl

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