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June 16, 2023
In the study, the liquid crystal material synthesized by 4-iodo-1-isobutyl-1H-pyrazole can achieve the ideal arrangement effect.
The molecular formula of the compound is C7H11IN2.
The molecular weight of the compound is 250.08 g/mol.
The IUPAC name of the compound is 4-iodo-1-(2-methylpropyl)pyrazole.
The InChI of the compound is InChI=1S/C7H11IN2/c1-6(2)4-10-5-7(8)3-9-10/h3,5-6H,4H2,1-2H3.
The InChIKey of the compound is PTARWFPVOYNYPY-UHFFFAOYSA-N.
The canonical SMILES of the compound is CC(C)CN1C=C(C=N1)I.
The CAS number of the compound is 918487-09-9.
The XLogP3-AA value of the compound is 2.1.
The compound has 0 hydrogen bond donor counts.
The compound has 2 rotatable bond counts.
918331-73-4
918-36-5
91840-27-6
918487-10-2
918523-59-8
918810-94-3
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