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2,2,5-三甲基-1,3-二氧杂环己烷-5-羧酸及2,2,5-三甲基-1,3-二氧杂环己烷-5-羧酸酐的合成与晶体结构

Syntheses and crystal structures of 2,2,5-trimethyl-1,3-dioxane-5-carb-oxy-lic acid and 2,2,5-trimethyl-1,3-dioxane-5-carb-oxy-lic anhydride.

作者信息

Giesen Joseph A, Grayson Scott M, Mague Joel T

机构信息

Department of Chemistry, Tulane University, New Orleans, LA 70118, USA.

出版信息

Acta Crystallogr E Crystallogr Commun. 2020 Jan 1;76(Pt 1):86-90. doi: 10.1107/S2056989019016670.

DOI:10.1107/S2056989019016670
PMID:31921458
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC6944095/
Abstract

In 2,2,5-trimethyl-1,3-dioxane-5-carb-oxy-lic acid, CHO, the carboxyl group occupies an equatorial position on the 1,3-dioxane ring. In the crystal, O-H⋯O hydrogen bonds form chains of mol-ecules, which are linked into a three-dimensional network by C-H⋯O hydrogen bonds. The asymmetric unit of 2,2,5-trimethyl-1,3-dioxane-5-carb-oxy-lic anhydride, CHO, consists of two independent mol-ecules, which are linked by C-H⋯O hydrogen bonds. In the crystal, these units are connected into corrugated layers two mol-ecules thick and parallel to the plane by additional C-H⋯O hydrogen bonds.

摘要

在2,2,5-三甲基-1,3-二氧六环-5-羧酸(CHO)中,羧基占据1,3-二氧六环环上的一个平伏位置。在晶体中,O-H⋯O氢键形成分子链,这些分子链通过C-H⋯O氢键连接成三维网络。2,2,5-三甲基-1,3-二氧六环-5-羧酸酐(CHO)的不对称单元由两个独立的分子组成,它们通过C-H⋯O氢键相连。在晶体中,这些单元通过额外的C-H⋯O氢键连接成两层分子厚且平行于 平面的波纹层。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/4f3a54e2a6f0/e-76-00086-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/7c1e3f2516b8/e-76-00086-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/0e0f4d1fdbb4/e-76-00086-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/1c1d4f044d23/e-76-00086-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/428e9d04e289/e-76-00086-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/0c2039a15d83/e-76-00086-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/4f3a54e2a6f0/e-76-00086-fig6.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/7c1e3f2516b8/e-76-00086-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/0e0f4d1fdbb4/e-76-00086-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/1c1d4f044d23/e-76-00086-fig3.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/428e9d04e289/e-76-00086-fig4.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/0c2039a15d83/e-76-00086-fig5.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/33a0/6944095/4f3a54e2a6f0/e-76-00086-fig6.jpg

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本文引用的文献

1
Enantioselective Total Synthesis of (+)-Plumisclerin A.对映选择性全合成 (+)-Plumisclerin A。
Angew Chem Int Ed Engl. 2018 Oct 1;57(40):13313-13318. doi: 10.1002/anie.201808517. Epub 2018 Sep 4.
2
Iodine-Containing Mass-Defect-Tuned Dendrimers for Use as Internal Mass Spectrometry Calibrants.用作内部质谱校准剂的含碘质量缺陷调谐树枝状大分子。
J Am Soc Mass Spectrom. 2018 Mar;29(3):490-500. doi: 10.1007/s13361-017-1849-y. Epub 2017 Dec 19.
3
Heterogeneous Rupturing Dendrimers.异质破树枝状大分子。
J Am Chem Soc. 2017 Dec 6;139(48):17660-17666. doi: 10.1021/jacs.7b10377. Epub 2017 Nov 22.
4
The Cambridge Structural Database.剑桥结构数据库。
Acta Crystallogr B Struct Sci Cryst Eng Mater. 2016 Apr;72(Pt 2):171-9. doi: 10.1107/S2052520616003954. Epub 2016 Apr 1.
5
Fluoride-Promoted Esterification (FPE) Chemistry: A Robust Route to Bis-MPA Dendrons and Their Postfunctionalization.氟化物促进的酯化反应(FPE)化学:通往双-MPA树枝状分子及其后功能化的可靠途径。
Molecules. 2016 Mar 17;21(3):366. doi: 10.3390/molecules21030366.
6
Comparison of silver and molybdenum microfocus X-ray sources for single-crystal structure determination.用于单晶结构测定的银和钼微焦点X射线源的比较。
J Appl Crystallogr. 2015 Jan 30;48(Pt 1):3-10. doi: 10.1107/S1600576714022985. eCollection 2015 Feb 1.
7
Fluoride-promoted esterification with imidazolide-activated compounds: a modular and sustainable approach to dendrimers.氟化物促进的与咪唑啉活化化合物的酯化反应:一种树枝状大分子的模块化和可持续方法。
Angew Chem Int Ed Engl. 2015 Feb 16;54(8):2416-9. doi: 10.1002/anie.201411370. Epub 2015 Jan 21.
8
Advantages of monodisperse and chemically robust "SpheriCal" polyester dendrimers as a "universal" MS calibrant.单分散且化学性质稳定的“球形”聚酯树枝状大分子作为“通用”质谱校准剂的优势。
J Am Soc Mass Spectrom. 2014 Mar;25(3):303-9. doi: 10.1007/s13361-013-0777-8. Epub 2013 Dec 3.
9
The mixed diol-dithiol 2,2-bis(sulfanylmethyl)propane-1,3-diol: characterization of key intermediates on a new synthetic pathway.
Acta Crystallogr C. 2011 Jan;67(Pt 1):o1-5. doi: 10.1107/S0108270110049371. Epub 2010 Dec 8.
10
A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.