2,1-Benzisoxazolium, 3-ethyl-1,3-dihydro-3-methyl-1-oxo-

Base Information

• Chemical Name: 2,1-Benzisoxazolium, 3-ethyl-1,3-dihydro-3-methyl-1-oxo-
• CAS No.: 54450-94-1
• Molecular Formula: C10H12NO2
• DSSTox Substance ID: DTXSID90483727

Synonyms:54450-94-1;2,1-Benzisoxazolium, 3-ethyl-1,3-dihydro-3-methyl-1-oxo-;QEODQDIXZZEENQ-UHFFFAOYSA-;DTXSID90483727;InChI=1/C10H12NO2/c1-3-10(2)8-6-4-5-7-9(8)11(12)13-10/h4-7H,3H2,1-2H3/q+1

Chemical Property of 2,1-Benzisoxazolium, 3-ethyl-1,3-dihydro-3-methyl-1-oxo-

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 178.086803626
• Heavy Atom Count: 13
• Complexity: 229

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1(C2=CC=CC=C2[N+](=O)O1)C

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