1-Isocyanato-4-[(trichloromethyl)sulfanyl]benzene

Base Information

• Chemical Name: 1-Isocyanato-4-[(trichloromethyl)sulfanyl]benzene
• CAS No.: 58555-12-7
• Molecular Formula: C8H4Cl3NOS
• DSSTox Substance ID: DTXSID20710114

Synonyms:58555-12-7;SCHEMBL11782330;DTXSID20710114;1-Isocyanato-4-[(trichloromethyl)sulfanyl]benzene

Chemical Property of 1-Isocyanato-4-[(trichloromethyl)sulfanyl]benzene

Chemical Property:

• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 266.907918
• Heavy Atom Count: 14
• Complexity: 229

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1N=C=O)SC(Cl)(Cl)Cl

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