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2-Methyl-sulfonyl-4-(trifluoro-meth-yl)benzoic acid.

ABSTRACT: In the title mol-ecule, C(9)H(7)F(3)O(4)S, the S and the methyl C atoms of the methyl-sulfonyl group deviate from the benzene ring plane by 0.185?(2) and -1.394?(3)?Å, respectively. In the crystal, O-H?O hydrogen bonds link the mol-ecules into chains along [201]. Weak C-H?O inter-actions further link these chains into layers parallel to the ac plane.

SUBMITTER: Yao LS

PROVIDER: S-EPMC3379423 | biostudies-literature | 2012 Jun

REPOSITORIES: biostudies-literature

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2-Methyl-sulfonyl-4-(trifluoro-meth-yl)benzoic acid.

Yao Lin-Shan LS We Bo B Gao Jin-Sheng JS

Acta crystallographica. Section E, Structure reports online 20120523 Pt 6

In the title mol-ecule, C(9)H(7)F(3)O(4)S, the S and the methyl C atoms of the methyl-sulfonyl group deviate from the benzene ring plane by 0.185 (2) and -1.394 (3) Å, respectively. In the crystal, O-H⋯O hydrogen bonds link the mol-ecules into chains along [201]. Weak C-H⋯O inter-actions further link these chains into layers parallel to the ac plane. ...[more]

PMID: 22719621

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