3-Oxospiro[benzimidazol-3-ium-2,1'-cyclohexan]-1(3H)-olate

Base Information

• Chemical Name: 3-Oxospiro[benzimidazol-3-ium-2,1'-cyclohexan]-1(3H)-olate
• CAS No.: 31983-86-5
• Molecular Formula: C₁₂H₁₄N₂O₂
• Molecular Weight: 218.255
• DSSTox Substance ID: DTXSID50493160
• Mol file: 31983-86-5.mol

Synonyms:31983-86-5;SCHEMBL10577091;DTXSID50493160;3-Oxospiro[benzimidazol-3-ium-2,1'-cyclohexan]-1(3H)-olate;spiro[2h-benz-imidazole-2,1'-cyclohexane] 1,3-dioxide

Chemical Property of 3-Oxospiro[benzimidazol-3-ium-2,1'-cyclohexan]-1(3H)-olate

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 218.105527694
• Heavy Atom Count: 16
• Complexity: 278

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC2(CC1)N(C3=CC=CC=C3[N+]2=O)[O-]

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