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Methyl 2-[(3,5-di-tert-butyl-4-hy-droxy-benz-yl)sulfan-yl]pyridine-3-carboxyl-ate n-hexane hemisolvate.

ABSTRACT: The title solvated ester, C(22)H(29)NO(3)S·0.5C(6)H(14), crystallizes with two independent mol-ecules along with a hexane mol-ecule in the asymmetric unit. The two aromatic rings are separated by an -CH(2)-S- linkage; the rings are aligned at 83.27?(4)° in one mol-ecule and 47.66?(7)° in the other. The hy-droxy group of one mol-ecule forms an O-H?O hydrogen bond to the other mol-ecule.

SUBMITTER: Ariffin A

PROVIDER: S-EPMC3379213 | biostudies-literature | 2012 Jun

REPOSITORIES: biostudies-literature

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Methyl 2-[(3,5-di-tert-butyl-4-hy-droxy-benz-yl)sulfan-yl]pyridine-3-carboxyl-ate n-hexane hemisolvate.

Ariffin Azhar A Nordin Nordiana N Yehye Wagee A WA Ng Seik Weng SW

Acta crystallographica. Section E, Structure reports online 20120502 Pt 6

The title solvated ester, C(22)H(29)NO(3)S·0.5C(6)H(14), crystallizes with two independent mol-ecules along with a hexane mol-ecule in the asymmetric unit. The two aromatic rings are separated by an -CH(2)-S- linkage; the rings are aligned at 83.27 (4)° in one mol-ecule and 47.66 (7)° in the other. The hy-droxy group of one mol-ecule forms an O-H⋯O hydrogen bond to the other mol-ecule. ...[more]

PMID: 22719411

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