Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate

Cresten Moodley; Alfred Muller; Yonas H. Belay

doi:10.1107/S2414314624001639

Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate

Cresten Moodley, Alfred Muller, Yonas H. Belay

Chemical Sciences

University of Johannesburg

Research output: Contribution to journal › Article › peer-review

Abstract

The title compound, C₁₄H₁₂O₄, comprises of two crystallographically independent molecules in the asymmetric unit, linked via C—H. . .O interactions to form dimeric entities. The allylic groups are twisted out of the phenyl planes with dihedral angles varying between 7.92 (13) and 25.42 (8)^̊. In the crystal, the packing follows a zigzag pattern along the c-axis direction. The absolute configuration of the sample could not be determined reliably.

Original language	English
Article number	x240163
Journal	IUCrData
Volume	9
Issue number	Pt 2
DOIs	https://doi.org/10.1107/S2414314624001639
Publication status	Published - Feb 2024

Keywords

crystal structure
dimer
hydrogen bonding

ASJC Scopus subject areas

Analytical Chemistry
Organic Chemistry
Inorganic Chemistry

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10.1107/S2414314624001639

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title = "Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate",

abstract = "The title compound, C14H12O4, comprises of two crystallographically independent molecules in the asymmetric unit, linked via C—H. . .O interactions to form dimeric entities. The allylic groups are twisted out of the phenyl planes with dihedral angles varying between 7.92 (13) and 25.42 (8)̊. In the crystal, the packing follows a zigzag pattern along the c-axis direction. The absolute configuration of the sample could not be determined reliably.",

keywords = "crystal structure, dimer, hydrogen bonding",

author = "Cresten Moodley and Alfred Muller and Belay, {Yonas H.}",

year = "2024",

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language = "English",

volume = "9",

journal = "IUCrData",

issn = "2414-3146",

publisher = "International Union of Crystallography",

number = "Pt 2",

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T1 - Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate

AU - Moodley, Cresten

AU - Muller, Alfred

AU - Belay, Yonas H.

PY - 2024/2

Y1 - 2024/2

N2 - The title compound, C14H12O4, comprises of two crystallographically independent molecules in the asymmetric unit, linked via C—H. . .O interactions to form dimeric entities. The allylic groups are twisted out of the phenyl planes with dihedral angles varying between 7.92 (13) and 25.42 (8)̊. In the crystal, the packing follows a zigzag pattern along the c-axis direction. The absolute configuration of the sample could not be determined reliably.

AB - The title compound, C14H12O4, comprises of two crystallographically independent molecules in the asymmetric unit, linked via C—H. . .O interactions to form dimeric entities. The allylic groups are twisted out of the phenyl planes with dihedral angles varying between 7.92 (13) and 25.42 (8)̊. In the crystal, the packing follows a zigzag pattern along the c-axis direction. The absolute configuration of the sample could not be determined reliably.

KW - crystal structure

KW - dimer

KW - hydrogen bonding

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U2 - 10.1107/S2414314624001639

DO - 10.1107/S2414314624001639

M3 - Article

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ER -

Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate

Abstract

Keywords

ASJC Scopus subject areas

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New Crystallography Research from University of Johannesburg Outlined [Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate]

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Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate

Abstract

Keywords

ASJC Scopus subject areas

Access to Document

Other files and links

Fingerprint

Press/Media

New Crystallography Research from University of Johannesburg Outlined [Prop-2-ynyl 3-methoxy-4-(prop-2-ynyloxy)benzoate]

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