934842-69-0 Purity
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The molecular formula of 2-Methoxybenzyl isocyanate is C9H9NO2.
The molecular weight of 2-Methoxybenzyl isocyanate is 163.17 g/mol.
The IUPAC name of 2-Methoxybenzyl isocyanate is 1-(isocyanatomethyl)-2-methoxybenzene.
The InChI of 2-Methoxybenzyl isocyanate is InChI=1S/C9H9NO2/c1-12-9-5-3-2-4-8(9)6-10-7-11/h2-5H,6H2,1H3.
The InChIKey of 2-Methoxybenzyl isocyanate is DTKFYMTVYBPJRC-UHFFFAOYSA-N.
The canonical SMILES of 2-Methoxybenzyl isocyanate is COC1=CC=CC=C1CN=C=O.
The CAS number of 2-Methoxybenzyl isocyanate is 93489-08-8.
The European Community (EC) number of 2-Methoxybenzyl isocyanate is 626-747-8.
The XLogP3 value of 2-Methoxybenzyl isocyanate is 2.8.
Yes, 2-Methoxybenzyl isocyanate is a canonicalized compound.