2,4,6-Cycloheptatrien-1-one, 2-(1H-pyrrol-1-ylamino)-

Base Information

• Chemical Name: 2,4,6-Cycloheptatrien-1-one, 2-(1H-pyrrol-1-ylamino)-
• CAS No.: 647841-44-9
• Molecular Formula: C₁₁H₁₀N₂O
• Molecular Weight: 186.213
• DSSTox Substance ID: DTXSID90467209

Synonyms:647841-44-9;2,4,6-Cycloheptatrien-1-one, 2-(1H-pyrrol-1-ylamino)-;DTXSID90467209

Chemical Property of 2,4,6-Cycloheptatrien-1-one, 2-(1H-pyrrol-1-ylamino)-

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 186.079312947
• Heavy Atom Count: 14
• Complexity: 309

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=O)C=C1)NN2C=CC=C2

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