1,1,2-Trichloro-4-methyl-3-nitropenta-1,3-diene

Base Information

• Chemical Name: 1,1,2-Trichloro-4-methyl-3-nitropenta-1,3-diene
• CAS No.: 106054-93-7
• Molecular Formula: C6H6Cl3NO2
• DSSTox Substance ID: DTXSID60543362

Synonyms:106054-93-7;1,1,2-Trichloro-4-methyl-3-nitropenta-1,3-diene;DTXSID60543362

Chemical Property of 1,1,2-Trichloro-4-methyl-3-nitropenta-1,3-diene

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 228.946412
• Heavy Atom Count: 12
• Complexity: 257

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=C(C(=C(Cl)Cl)Cl)[N+](=O)[O-])C

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