137258-12-9 Purity
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Specification
The molecular formula of 1,4-Diiodo-2,5-dioctylbenzene is C22H36I2.
The molecular weight of 1,4-Diiodo-2,5-dioctylbenzene is 554.3 g/mol.
The IUPAC name of 1,4-Diiodo-2,5-dioctylbenzene is 1,4-diiodo-2,5-dioctylbenzene.
The InChI of 1,4-Diiodo-2,5-dioctylbenzene is InChI=1S/C22H36I2/c1-3-5-7-9-11-13-15-19-17-22(24)20(18-21(19)23)16-14-12-10-8-6-4-2/h17-18H,3-16H2,1-2H3.
The InChIKey of 1,4-Diiodo-2,5-dioctylbenzene is JNTDOQWSWMNCCX-UHFFFAOYSA-N.
The canonical SMILES of 1,4-Diiodo-2,5-dioctylbenzene is CCCCCCCCC1=CC(=C(C=C1I)CCCCCCCC)I.
The CAS number of 1,4-Diiodo-2,5-dioctylbenzene is 171569-01-0.
The European Community (EC) number of 1,4-Diiodo-2,5-dioctylbenzene is 622-656-2.
The DSSTox Substance ID of 1,4-Diiodo-2,5-dioctylbenzene is DTXSID50584522.
Yes, 1,4-Diiodo-2,5-dioctylbenzene is a canonicalized compound according to PubChem.