2-Bromobenzoyl isothiocyanate

Base Information

• Chemical Name: 2-Bromobenzoyl isothiocyanate
• CAS No.: 62721-89-5
• Molecular Formula: C8H4BrNOS
• DSSTox Substance ID: DTXSID30538301
• Nikkaji Number: J3.364.745J

Synonyms:2-bromobenzoyl isothiocyanate;Benzoyl isothiocyanate, bromo-;62721-89-5;SCHEMBL5824686;DTXSID30538301;NGMPJZGCZSYAAR-UHFFFAOYSA-N;AKOS005202561;2-Bromo-1-benzenecarbonyl isothiocyanate

Chemical Property of 2-Bromobenzoyl isothiocyanate

Chemical Property:

• XLogP3: 4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 240.91970
• Heavy Atom Count: 12
• Complexity: 225

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)N=C=S)Br

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