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Ethyl 3-(4-geranyl­oxy-3-methoxy­phenyl)-2-propenoate

✍ Scribed by Miyake, Yasuhito ;Hosoda, Asao ;Nomura, Eisaku ;Taniguchi, Hisaji

Publisher
International Union of Crystallography
Year
2001
Tongue
English
Weight
138 KB
Volume
57
Category
Article
ISSN
1600-5368

No coin nor oath required. For personal study only.

✦ Synopsis

The title compound, C 22 H 30 O 4 , is known as a chemopreventive agent against colon tumor development. The molecular structure is nearly planar, showing a trans arrangement with respect to the C C bond of the phenylpropenoate moiety.

📜 SIMILAR VOLUMES

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Single-crystal X-ray study T = 296 K Mean '(C±C) = 0.003 A Ê R factor = 0.034 wR factor = 0.101 Data-to-parameter ratio = 12.1 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.

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In the title molecule, C 18 H 16 O 3 , the configuaration with respect to the C C double bond is E. The benzoyl group is rotated out of the mean plane through the rest of the molecule by 88.31 (4) . In the crystal structure, molecules are linked by weak intermolecular C-HÁ Á ÁO interactions to form

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Single-crystal X-ray study T = 250 K Mean '(C±C) = 0.004 A Ê R factor = 0.056 wR factor = 0.156 Data-to-parameter ratio = 15.2 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.