916420-25-2 Purity
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Specification
The molecular formula of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is C6H3ClIN3.
The molecular weight of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is 279.46 g/mol.
The IUPAC name of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is 4-chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine.
The InChI of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is InChI=1S/C6H3ClIN3/c7-6-5-1-4(8)2-11(5)10-3-9-6/h1-3H.
The InChIKey of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is IAXOZWTXSDGIEI-UHFFFAOYSA-N.
The canonical SMILES of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is C1=C2C(=NC=NN2C=C1I)Cl.
The CAS number of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is 916420-31-0.
The DSSTox Substance ID of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is DTXSID70735079.
The XLogP3-AA value of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is 2.
The topological polar surface area of 4-Chloro-6-iodopyrrolo[2,1-f][1,2,4]triazine is 30.2 ?2.