{"database":"biostudies-literature","file_versions":[],"scores":null,"additional":{"omics_type":["Unknown"],"volume":["66(Pt 7)"],"submitter":["Lulinski S"],"pubmed_abstract":["In the title mol-ecule, C(18)H(23)BO(4), the dihedral angle between the least-squares planes of the aromatic rings is 84.88 (3)°. The B atom deviates by 0.202 (1) Å from the least-squares plane of the mesityl ring. All of the meth-oxy groups are approximately coplanar with the 2,4,6-trimeth-oxy-phenyl ring, whereas the BOH group is twisted with respect to it by 19.5°. The borinic OH group is engaged in an intra-molecular O-H⋯O hydrogen bond with one of ortho-meth-oxy groups. The mol-ecular structure is stabilized by weak C-H⋯O contacts. In the crystal, mol-ecules are linked by weak C-H⋯O and C-H⋯π inter-actions, generating a three-dimensional network."],"journal":["Acta crystallographica. Section E, Structure reports online"],"pagination":["o1711-2"],"full_dataset_link":["https://www.ebi.ac.uk/biostudies/studies/S-EPMC3006901"],"repository":["biostudies-literature"],"pubmed_title":["Mesit-yl(2,4,6-trimeth-oxy-phen-yl)borinic acid."],"pmcid":["PMC3006901"],"pubmed_authors":["Lulinski S","Serwatowski J"],"additional_accession":[]},"is_claimable":false,"name":"Mesit-yl(2,4,6-trimeth-oxy-phen-yl)borinic acid.","description":"In the title mol-ecule, C(18)H(23)BO(4), the dihedral angle between the least-squares planes of the aromatic rings is 84.88 (3)°. The B atom deviates by 0.202 (1) Å from the least-squares plane of the mesityl ring. All of the meth-oxy groups are approximately coplanar with the 2,4,6-trimeth-oxy-phenyl ring, whereas the BOH group is twisted with respect to it by 19.5°. The borinic OH group is engaged in an intra-molecular O-H⋯O hydrogen bond with one of ortho-meth-oxy groups. The mol-ecular structure is stabilized by weak C-H⋯O contacts. In the crystal, mol-ecules are linked by weak C-H⋯O and C-H⋯π inter-actions, generating a three-dimensional network.","dates":{"release":"2010-01-01T00:00:00Z","publication":"2010 Jun","modification":"2025-04-26T05:03:17.893Z","creation":"2019-03-27T00:00:34Z"},"accession":"S-EPMC3006901","cross_references":{"pubmed":["21587929"],"doi":["10.1107/S160053681002297X"]}}