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The molecular formula of 2,5-Dibromophenyl isothiocyanate is C7H3Br2NS.
The molecular weight of 2,5-Dibromophenyl isothiocyanate is 292.98 g/mol.
The IUPAC name of 2,5-Dibromophenyl isothiocyanate is 1,4-dibromo-2-isothiocyanatobenzene.
The InChI code of 2,5-Dibromophenyl isothiocyanate is InChI=1S/C7H3Br2NS/c8-5-1-2-6(9)7(3-5)10-4-11/h1-3H.
The InChIKey of 2,5-Dibromophenyl isothiocyanate is JYMRVQQSUHKIST-UHFFFAOYSA-N.
The canonical SMILES of 2,5-Dibromophenyl isothiocyanate is C1=CC(=C(C=C1Br)N=C=S)Br.
The CAS number of 2,5-Dibromophenyl isothiocyanate is 98041-67-9.
The XLogP3-AA value of 2,5-Dibromophenyl isothiocyanate is 4.7.
Yes, 2,5-Dibromophenyl isothiocyanate is a canonicalized compound.
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