N-(2,1-Benzisothiazol-3-yl)-3-methylbutanamide

Base Information

• Chemical Name: N-(2,1-Benzisothiazol-3-yl)-3-methylbutanamide
• CAS No.: 67019-24-3
• Molecular Formula: C12H14 N2 O S
• Molecular Weight: 234.3174
• DSSTox Substance ID: DTXSID20985865
• Nikkaji Number: J629.914H
• Wikidata: Q82973558
• Mol file: 67019-24-3.mol

Synonyms:N-(2,1-Benzisothiazol-3-yl)-3-methylbutanamide;CCRIS 8348;67019-24-3;Butanamide, N-(2,1-benzisothiazol-3-yl)-3-methyl-;DTXSID20985865;N-(2,1-Benzothiazol-3-yl)-3-methylbutanimidic acid

Chemical Property of N-(2,1-Benzisothiazol-3-yl)-3-methylbutanamide

Chemical Property:

• Vapor Pressure: 1.08E-07mmHg at 25°C
• Boiling Point: 432.7°C at 760 mmHg
• Flash Point: 215.5°C
• Density: 1.238g/cm³
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 234.08268425
• Heavy Atom Count: 16
• Complexity: 257

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC(C)CC(=O)NC1=C2C=CC=CC2=NS1