2-Bromo-3-nitrotoluene

Crystal structure of 2-bromo-3-nitrotoluene has been studied and the dihedral angle between the nitro group and the phenyl ring is reported to be 54. 1(4)°.

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Catalog Number CBB1121056
Molecular Formula CH3C6H3(NO2)Br
CAS# 41085-43-2
Purity >99%
Inchi 1S/C7H6BrNO2/c1-5-3-2-4-6(7(5)8)9(10)11/h2-4H,1H3
Inchi Key GCAAVRIWNMTOKB-UHFFFAOYSA-N
SMILES Cc1cccc(c1Br)[N+]([O-])=O
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