(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetonitrile

Base Information

• Chemical Name: (3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetonitrile
• CAS No.: 1172831-14-9
• Molecular Formula: C7H8N4O2
• Molecular Weight: 180.16
• DSSTox Substance ID: DTXSID301244686
• Mol file: 1172831-14-9.mol

Synonyms:(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetonitrile;1172831-14-9;2-(3,5-Dimethyl-4-nitro-1H-pyrazol-1-yl)acetonitrile;2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetonitrile;DTXSID301244686;STK503262;AKOS002657097;3,5-Dimethyl-4-nitro-1H-pyrazole-1-acetonitrile

Chemical Property of (3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)acetonitrile

Chemical Property:

• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 180.06472551
• Heavy Atom Count: 13
• Complexity: 253

Purity/Quality:

98%min ^*data from raw suppliers

(3,5-Dimethyl-4-nitro-1H-pyrazol-1-yl)acetonitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(=NN1CC#N)C)[N+](=O)[O-]