Literature DB >> 11313582

4-Ethoxycarbonyl-3-hydroxy-3-phenylcyclohexanone.

S Hernández-Ortega1, F Jiménez-Cruz, H Ríos-Olivares, M Rubio-Arroyo.   

Abstract

The title compound, ethyl 2-hydroxy-4-oxo-2-phenylcyclohexanecarboxylate, C(15)H(18)O(4), was obtained by a Michael-Aldol condensation and has the cyclohexanone in a chair conformation. The attached hydroxy, ethoxycarbonyl and phenyl groups are disposed in beta-axial, beta-equatorial and alpha-equatorial configurations, respectively. An intermolecular hydrogen bond, with an O.O distance of 2.874 (2) A, links the OH group and the ring carbonyl. Weak intermolecular C-H.O=C (ester and ketone), O-H.O=C (ketone) and C-H.OH hydrogen bonds exist.

Entities:  

Year:  2001        PMID: 11313582     DOI: 10.1107/s0108270100020461

Source DB:  PubMed          Journal:  Acta Crystallogr C        ISSN: 0108-2701            Impact factor:   1.172


  1 in total

1.  rac-syn-Diethyl 2-hy-droxy-4-oxo-1-phenyl-cyclo-hexane-1,2-dicarboxyl-ate.

Authors:  Ya-Jun Wang; Sheng-Liang Ni; Yue Meng
Journal:  Acta Crystallogr Sect E Struct Rep Online       Date:  2011-10-22
  1 in total

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