1,2-Benzisothiazole-3-carbonitrile

Base Information

• Chemical Name: 1,2-Benzisothiazole-3-carbonitrile
• CAS No.: 16807-20-8
• Molecular Formula: C₈H₄N₂S
• Molecular Weight: 160.199
• European Community (EC) Number: 870-069-7
• Nikkaji Number: J2.438.634A
• Mol file: 16807-20-8.mol

Synonyms:1,2-Benzisothiazole-3-carbonitrile;16807-20-8;1,2-benzothiazole-3-carbonitrile;Benzo[d]isothiazole-3-carbonitrile;SCHEMBL4102645;ORRUMXODEQSYDQ-UHFFFAOYSA-N;EN300-6827033;Z3241894086

Chemical Property of 1,2-Benzisothiazole-3-carbonitrile

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 160.00951931
• Heavy Atom Count: 11
• Complexity: 196

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=NS2)C#N