1-(4-bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole

Base Information

• Chemical Name: 1-(4-bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
• CAS No.: 333311-69-6
• Molecular Formula: C12H12BrN3O2
• Molecular Weight: 310.15
• DSSTox Substance ID: DTXSID001194676
• Mol file: 333311-69-6.mol

Synonyms:333311-69-6;1-(4-bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole;1-(4-Bromo-benzyl)-3,5-dimethyl-4-nitro-1H-pyrazole;1-[(4-bromophenyl)methyl]-3,5-dimethyl-4-nitropyrazole;1-[(4-Bromophenyl)methyl]-3,5-dimethyl-4-nitro-1H-pyrazole;Oprea1_185849;DTXSID001194676;BBL038396;MFCD02732842;STK305293;AKOS000311419;AKOS015922633;CS-0282734;EN300-229942;SR-01000282918;SR-01000282918-1

Chemical Property of 1-(4-bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 309.01129
• Heavy Atom Count: 18
• Complexity: 302

Purity/Quality:

99% ^*data from raw suppliers

1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=NN1CC2=CC=C(C=C2)Br)C)[N+](=O)[O-]

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