4-iodo-3-nitro-1H-pyrazole

Base Information

• Chemical Name: 4-iodo-3-nitro-1H-pyrazole
• CAS No.: 400753-02-8
• Molecular Formula: C₃H₂IN₃O₂
• Molecular Weight: 238.972
• Hs Code.: 2933199090
• European Community (EC) Number: 854-193-9
• DSSTox Substance ID: DTXSID10392423
• Nikkaji Number: J3.120.089J
• Wikidata: Q82190642
• Mol file: 400753-02-8.mol

Synonyms:4-iodo-3-nitro-1H-pyrazole;400753-02-8;4-iodo-5-nitro-1H-pyrazole;iodonitropyrazole;3-Nitro-4-iodo-1H-pyrazole;SCHEMBL9821783;DTXSID10392423;MFCD01821344;STK506174;AKOS005172428;AKOS025394674;SB12155;BB 0262033;CS-0188754;EN300-232258

Chemical Property of 4-iodo-3-nitro-1H-pyrazole

Chemical Property:

• PSA: 74.50000
• LogP: 1.44570
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 238.91917
• Heavy Atom Count: 9
• Complexity: 125

Purity/Quality:

97% ^*data from raw suppliers

4-Iodo-3-nitro-1H-pyrazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NNC(=C1I)[N+](=O)[O-]

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