97966-00-2 Purity
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Specification
The molecular formula of 2-Bromo-1,3-dimethylbenzene is C8H9Br.
The molecular weight of 2-Bromo-1,3-dimethylbenzene is 185.06 g/mol.
The IUPAC name of 2-Bromo-1,3-dimethylbenzene is 2-bromo-1,3-dimethylbenzene.
The InChI of 2-Bromo-1,3-dimethylbenzene is InChI=1S/C8H9Br/c1-6-4-3-5-7(2)8(6)9/h3-5H,1-2H3.
The InChIKey of 2-Bromo-1,3-dimethylbenzene is MYMYVYZLMUEVED-UHFFFAOYSA-N.
The canonical SMILES of 2-Bromo-1,3-dimethylbenzene is CC1=C(C(=CC=C1)C)Br.
The CAS number of 2-Bromo-1,3-dimethylbenzene is 576-22-7.
The European Community (EC) number of 2-Bromo-1,3-dimethylbenzene is 209-397-7.
Yes, 2-Bromo-1,3-dimethylbenzene is a canonicalized compound.