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| IUPAC Name: | 4-iodo-5-methyl-1H-pyrazole |
| Description: | 4-Iodo-3-methylpyrazole (CAS# 15802-75-2) is an analog of 4-Bromo-3-methylpyrazole (B688090) which is an intermdiate used to prepare substituted piperidines as potent, selective, CNS-penetrant α4β2 nicotinic acetylcholine receptor potentiators. 4-Bromo-3-methylpyrazole is also used to prepare small molecular B2 receptor antagonists. |
| Molecular Weight: | 208.00 |
| Molecular Formula: | C4H5IN2 |
| Canonical SMILES: | CC1=C(C=NN1)I |
| InChI: | InChI=1S/C4H5IN2/c1-3-4(5)2-6-7-3/h2H,1H3,(H,6,7) |
| InChI Key: | SHDMYGCRVXWTGR-UHFFFAOYSA-N |
| Boiling Point: | 292.1 ℃ at 760 mmHg |
| Density: | 2.094 g/cm3 |
| MDL: | MFCD15146426 |
| LogP: | 1.32270 |
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