4-Bromo-4-(4-methoxyphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one

Base Information

• Chemical Name: 4-Bromo-4-(4-methoxyphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
• CAS No.: 13051-08-6
• Molecular Formula: C₁₁H₁₁BrN₂O₂
• Molecular Weight: 283.125
• NSC Number: 109914
• DSSTox Substance ID: DTXSID60926898

Synonyms:13051-08-6;4-Bromo-4-(4-methoxyphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one;4-bromo-4-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5-one;NSC109914;NSC 109914;3H-Pyrazol-3-one, 4-bromo-2,4-dihydro-4-(4-methoxyphenyl)-5-methyl-;DTXSID60926898;NSC-109914;130778-21-1;4-Bromo-4-(4-methoxyphenyl)-5-methyl-4H-pyrazol-3-ol;4-Bromo-4-(4-methoxyphenyl)-3-methyl-1H-pyrazol-5(4H)-one

Chemical Property of 4-Bromo-4-(4-methoxyphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one

Chemical Property:

• Density: 1.55g/cm³
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 282.00039
• Heavy Atom Count: 16
• Complexity: 324

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NNC(=O)C1(C2=CC=C(C=C2)OC)Br

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