8-Methylsulfinyloctyl isothiocyanate

Base Information

• Chemical Name: 8-Methylsulfinyloctyl isothiocyanate
• CAS No.: 75272-81-0
• Molecular Formula: C10H19NOS2
• Molecular Weight: 233.39400
• DSSTox Substance ID: DTXSID40430802
• Nikkaji Number: J1.151.544D
• Wikidata: Q27163088
• Mol file: 75272-81-0.mol

Synonyms:8-methylsulfinoctyl isothiocyanate;8-methylsulfinyloctyl isothiocyanate;8-MITC;MSO isothiocyanate

Chemical Property of 8-Methylsulfinyloctyl isothiocyanate

Chemical Property:

• PSA: 80.73000
• LogP: 3.67400
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 233.09080658
• Heavy Atom Count: 14
• Complexity: 200

Purity/Quality:

99% ^*data from raw suppliers

1-ISOTHIOCYANATO-8-(METHYLSULFINYL)-OCTANE 98.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)CCCCCCCCN=C=S

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