CAS
917202-02-9 Purity
>98
917202-02-9 Purity
>98
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The molecular formula is C12H14BrN.
The molecular weight is 252.15 g/mol.
The IUPAC Name is 6-bromo-2,2,4-trimethyl-1H-quinoline.
InChI=1S/C12H14BrN/c1-8-7-12(2,3)14-11-5-4-9(13)6-10(8)11/h4-7,14H,1-3H3
The InChIKey is GQPOSFWEURXXNF-UHFFFAOYSA-N.
CC1=CC(NC2=C1C=C(C=C2)Br)(C)C.
It has 1 Hydrogen Bond Donor Count.
The XLogP3-AA value is 3.5.
The Topological Polar Surface Area is 122.
Yes, it is a canonicalized compound.