| Identification | Back Directory | [Name]
IMIDAZOLE-D4 | [CAS]
6923-01-9 | [Synonyms]
IMIDAZOLE-D4
1H-Imidazole
Benzimidazole-d6
IMIDAZOLE (D4, 98%)
1H-Imidazole-1,2,4,5-d4
Imidazole-d4
Imidazole-d4,98 atom %D
IMIDAZOLE-D4, 95 ATOM % D
1,2,4,5-tetradeuterioimidazole | [Molecular Formula]
C3H4N2 | [MDL Number]
MFCD00082554 | [MOL File]
6923-01-9.mol | [Molecular Weight]
68.08 |
| Chemical Properties | Back Directory | [Melting point ]
89-91 °C(lit.) | [Boiling point ]
256 °C(lit.) | [Fp ]
145℃ | [form ]
powder | [pka]
6.953(at 25℃) | [InChI]
1S/C3H4N2/c1-2-5-3-4-1/h1-3H,(H,4,5)/i1D,2D,3D/hD | [InChIKey]
RAXXELZNTBOGNW-MSWVZFBTSA-N | [SMILES]
[2H]c1nc([2H])n([2H])c1[2H] | [CAS Number Unlabeled]
288-32-4 |
| Safety Data | Back Directory | [Hazard Codes ]
C,T | [Risk Statements ]
22-34-61 | [Safety Statements ]
22-26-36/37/39-45-53 | [RIDADR ]
UN 3259 8/PG 2 | [WGK Germany ]
3 | [Storage Class]
6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects | [Hazard Classifications]
Acute Tox. 4 Oral
Eye Dam. 1
Repr. 1B
Skin Corr. 1B |
| Hazard Information | Back Directory | [Uses]
Imidazole-d4 may be used in the synthesis of 1-ethylimidazole-d8 by reacting with ethyl iodide-d5 and 1-butylimidazole-d12 by reacting with butyl iodide-d9. These compounds form the precursors for the preparation of perdeuterated cellulose solvents, 1-ethyl-3-methylimidazolium acetate (EMIM-OAc-d14) and 1-butyl-3-methylimidazolium acetate (BMIM-OAc-d18). | [Uses]
Imidazole-d4 is a labelled imidazole, a versatile heterocycle used in the preparation of various biologically active compounds such as the amino acid histidine and is present in many antifungal medication. It is also used extensively as a corrosion inhibitor on transition metals such as copper. | [General Description]
Imidazole-d4 is a deuterated NMR solvent useful in NMR-based research and analyses. Far-infrared spectrum of imidazole-d4 in the range of 300-33-cm-1 has been investigated. |
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