| Identification | More | [Name]
3,5-Dimethyl-4-nitro-1H-pyrazole | [CAS]
14531-55-6 | [Synonyms]
3,5-DIMETHYL-4-NITRO-1H-PYRAZOLE
4-NITRO-3,5-DIMETHYL-1H-PYRAZOLE
AKOS 90439
AKOS B001468
ART-CHEM-BB B001468
TIMTEC-BB SBB009217
5-23-05-00160 (Beilstein Handbook Reference)
1H-Pyrazole,3,5-dimethyl-4-nitro-(9CI) | [Molecular Formula]
C5H7N3O2 | [MDL Number]
MFCD00052513 | [Molecular Weight]
141.13 | [MOL File]
14531-55-6.mol |
| Chemical Properties | Back Directory | [Melting point ]
125.0 to 129.0 °C | [Boiling point ]
325°C(lit.) | [density ]
1.339±0.06 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,Room Temperature | [form ]
powder to crystal | [pka]
10.75±0.50(Predicted) | [color ]
White to Almost white | [λmax]
274nm(CHCl3)(lit.) | [InChI]
InChI=1S/C5H7N3O2/c1-3-5(8(9)10)4(2)7-6-3/h1-2H3,(H,6,7) | [InChIKey]
OFQCJVVJRNPSET-UHFFFAOYSA-N | [SMILES]
N1C(C)=C([N+]([O-])=O)C(C)=N1 | [CAS DataBase Reference]
14531-55-6(CAS DataBase Reference) |
| Hazard Information | Back Directory | [Uses]
As Pyrazoles compound, 3,5-Dimethyl-4-nitro-1H-pyrazole has the key structures in numerous compounds of therapeutic importance. Compounds containing this ring system are known to display diverse pharmacological activities, for example as antimalarial agents , anti-inflammatory agents, and against cardiovascular disease.[1] | [References]
[1] Edward R T Tiekink, James L Wardell, Solange M S V Wardell. “3,5-Dimethyl-1-(4-nitro-phen-yl)-1H-pyrazole.” Acta crystallographica. Section E, Structure reports online 68 Pt 4 (2012): o1018. |
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