2-(Butane-1-sulfonyl)acetonitrile

Base Information

• Chemical Name: 2-(Butane-1-sulfonyl)acetonitrile
• CAS No.: 98548-92-6
• Molecular Formula: C6H11NO2S
• Molecular Weight: 161.22200
• DSSTox Substance ID: DTXSID20606568
• Wikidata: Q82505371

Synonyms:2-(butane-1-sulfonyl)acetonitrile;98548-92-6;2-butylsulfonylacetonitrile;SCHEMBL4073621;(Butane-1-sulfonyl)acetonitrile;DTXSID20606568;AKOS009809657;CS-0236936;EN300-175392;G54206

Chemical Property of 2-(Butane-1-sulfonyl)acetonitrile

Chemical Property:

• PSA: 66.31000
• LogP: 1.80568
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 161.05104977
• Heavy Atom Count: 10
• Complexity: 216

Purity/Quality:

2-(butane-1-sulfonyl)acetonitrile ^*data from reagent suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCS(=O)(=O)CC#N

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