Smith, Graham (2012) Isopropyl 2,2-bis(4-bromophenyl)-2-hydroxyacetate. Acta Crystallographica Section E: Structure Reports Online, 68(12), o3276-o3276.
In the structure of the title compound C17H16Br2O3, which is a restricted commercial acaricide (common name bromopropylate), has two independent and conformationally similar molecules in the asymmetric unit [dihedral angle between the planes of the two phenyl rings in each, 68.7(4) and 77.4(5)deg]. The C-atoms of the isopropyl group of one of the molecules are disordered over two sites with occupancies of 0.638 and 0.362. Minor non-merohedral twinning was also present in the crystal. Intermolecular hydrogen-bonding interactions involving the hydroxy groups and carboxyl O-atom acceptors give separate centrosymmetric homodimers through cyclic hydrogen-bonding motifs [graph set R2/2(10)].
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|Item Type:||Journal Article|
|Keywords:||crystal structure, bromopropylate, acaricide, hydrogen bonding|
|Subjects:||Australian and New Zealand Standard Research Classification > CHEMICAL SCIENCE (030000) > PHYSICAL CHEMISTRY (INCL. STRUCTURAL) (030600)|
|Divisions:||Current > Schools > School of Chemistry, Physics & Mechanical Engineering|
Current > QUT Faculties and Divisions > Science & Engineering Faculty
|Copyright Owner:||Copyright 2012 Blackwell Munksgaard|
|Deposited On:||05 Nov 2012 11:10|
|Last Modified:||06 Nov 2012 09:44|
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