4-Isothiazolecarbonitrile, 3-chloro-5-methyl-

Base Information

• Chemical Name: 4-Isothiazolecarbonitrile, 3-chloro-5-methyl-
• CAS No.: 647016-67-9
• Molecular Formula: C5H3ClN2S
• DSSTox Substance ID: DTXSID10451625
• Nikkaji Number: J1.943.818J
• Wikidata: Q82271731

Synonyms:4-Isothiazolecarbonitrile, 3-chloro-5-methyl-;647016-67-9;SCHEMBL11948730;DTXSID10451625;5-Methyl-3-chloroisothiazole-4-carbonitrile

Chemical Property of 4-Isothiazolecarbonitrile, 3-chloro-5-methyl-

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 157.9705470
• Heavy Atom Count: 9
• Complexity: 152

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=NS1)Cl)C#N

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