4-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinone
In the molecule of the title compound, C17H13BrO4, the anthraquinone ring system is slightly bent, with a dihedral angle of 169.99 (7)° between the planes of the two benzene rings. The side chain (O—C—C—C—Br) has a gauche–gauche conformation, as indicated by the O—C—C—C and C—C—C—Br torsion angles o...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
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International Union of Crystallography
2016-05-01
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| Series: | IUCrData |
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| Online Access: | http://scripts.iucr.org/cgi-bin/paper?S2414314616007537 |
| _version_ | 1819267024780525568 |
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| author | Natsumi Ohira Munenori Takehara Yoshinori Inoue Chitoshi Kitamura |
| author_facet | Natsumi Ohira Munenori Takehara Yoshinori Inoue Chitoshi Kitamura |
| author_sort | Natsumi Ohira |
| collection | DOAJ |
| description | In the molecule of the title compound, C17H13BrO4, the anthraquinone ring system is slightly bent, with a dihedral angle of 169.99 (7)° between the planes of the two benzene rings. The side chain (O—C—C—C—Br) has a gauche–gauche conformation, as indicated by the O—C—C—C and C—C—C—Br torsion angles of −66.9 (2) and −65.8 (2)°, respectively. In addition, there is an intramolecular O—H...O hydrogen bond enclosing an S(6) ring motif. The hydrogen-bond donor is bifurcated; in the crystal, a pair of O—H...O hydrogen bonds connects two molecules, forming an inversion dimer with an R22(12) ring motif. |
| first_indexed | 2024-12-23T21:10:36Z |
| format | Article |
| id | doaj.art-1440eea3d7d34c1d8dca3def9ca76685 |
| institution | Directory Open Access Journal |
| issn | 2414-3146 |
| language | English |
| last_indexed | 2024-12-23T21:10:36Z |
| publishDate | 2016-05-01 |
| publisher | International Union of Crystallography |
| record_format | Article |
| series | IUCrData |
| spelling | doaj.art-1440eea3d7d34c1d8dca3def9ca766852022-12-21T17:31:05ZengInternational Union of CrystallographyIUCrData2414-31462016-05-0115x16075310.1107/S2414314616007537pk40054-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinoneNatsumi Ohira0Munenori Takehara1Yoshinori Inoue2Chitoshi Kitamura3Department of Materials Science, School of Engineering, The University of Shiga Prefecture, 2500 Hassaka-cho, Hikone, Shiga 522-8533, JapanDepartment of Materials Science, School of Engineering, The University of Shiga Prefecture, 2500 Hassaka-cho, Hikone, Shiga 522-8533, JapanDepartment of Materials Science, School of Engineering, The University of Shiga Prefecture, 2500 Hassaka-cho, Hikone, Shiga 522-8533, JapanDepartment of Materials Science, School of Engineering, The University of Shiga Prefecture, 2500 Hassaka-cho, Hikone, Shiga 522-8533, JapanIn the molecule of the title compound, C17H13BrO4, the anthraquinone ring system is slightly bent, with a dihedral angle of 169.99 (7)° between the planes of the two benzene rings. The side chain (O—C—C—C—Br) has a gauche–gauche conformation, as indicated by the O—C—C—C and C—C—C—Br torsion angles of −66.9 (2) and −65.8 (2)°, respectively. In addition, there is an intramolecular O—H...O hydrogen bond enclosing an S(6) ring motif. The hydrogen-bond donor is bifurcated; in the crystal, a pair of O—H...O hydrogen bonds connects two molecules, forming an inversion dimer with an R22(12) ring motif.http://scripts.iucr.org/cgi-bin/paper?S2414314616007537crystal structureanthraquinonehydrogen bonds |
| spellingShingle | Natsumi Ohira Munenori Takehara Yoshinori Inoue Chitoshi Kitamura 4-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinone IUCrData crystal structure anthraquinone hydrogen bonds |
| title | 4-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinone |
| title_full | 4-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinone |
| title_fullStr | 4-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinone |
| title_full_unstemmed | 4-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinone |
| title_short | 4-(3-Bromopropyloxy)-1-hydroxy-9,10-anthraquinone |
| title_sort | 4 3 bromopropyloxy 1 hydroxy 9 10 anthraquinone |
| topic | crystal structure anthraquinone hydrogen bonds |
| url | http://scripts.iucr.org/cgi-bin/paper?S2414314616007537 |
| work_keys_str_mv | AT natsumiohira 43bromopropyloxy1hydroxy910anthraquinone AT munenoritakehara 43bromopropyloxy1hydroxy910anthraquinone AT yoshinoriinoue 43bromopropyloxy1hydroxy910anthraquinone AT chitoshikitamura 43bromopropyloxy1hydroxy910anthraquinone |