Imidazole, 2-trifluoromethyl-5-nitro- structure

Imidazole, 2-trifluoromethyl-5-nitro-

5-nitro-2-(trifluoromethyl)-1H-imidazole

Also Known As: Imidazole, 2-trifluoromethyl-5-nitro-|1H-Imidazole, 5-nitro-2-(trifluoromethyl)-|2-(Trifluoromethyl)-4-nitro-1H-imidazole|4-nitro-2-(trifluoromethyl)-1H-imidazole|5-Nitro-2-(trifluoromethyl)-1H-imidazole|5-Nitro-2-(trifluoromethyl)-1H-imidazole #|J1.091.955J

CAS: 104752-67-2
Molecular Formula C4H2F3N3O2
Molecular Weight 181.00992 g/mol
LogP 0.8
Topological Polar Surface Area 74.5 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 0
Exact Mass 181.00992
Monoisotopic Mass 181.00992
Heavy Atoms 12
Complexity 189.0

Chemical Identifiers

CAS Number 104752-67-2
SMILES C1=C(NC(=N1)C(F)(F)F)[N+](=O)[O-]
InChIKey VBXNQIJUKVDWNT-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (1 patents)

Product Overview

Imidazole, 2-trifluoromethyl-5-nitro- (CAS 104752-67-2), with molecular formula C4H2F3N3O2 and molecular weight 181.00992 g/mol. IUPAC: 5-nitro-2-(trifluoromethyl)-1H-imidazole.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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