Ethyl 2,6-Dimethoxybenzoate: Synthesis, Spectroscopic and X-ray Crystallographic Analysis
Abstract
:1. Introduction
2. Results and Discussion
Atoms | Bond length | Atoms | Bond angle |
---|---|---|---|
O(2')-C(6') | 1.367(2) | C(6')-O(2')-C(8') | 116.91(14) |
O(2')-C(8') | 1.429(2) | C(2')-O(1')-C(7') | 116.82(16) |
O(3')-C(9') | 1.202(2) | C(9')-O(4')-C(10') | 117.21(14) |
O(1')-C(2') | 1.362(2) | C(6)-O(2)-C(8) | 117.52(15) |
O(1')-C(7') | 1.432(2) | O(2')-C(6')-C(1') | 115.06(16) |
O(4')-C(9') | 1.336(2) | O(1')-C(2')-C(3') | 125.07(17) |
O(4')-C(10') | 1.456(2) | O(2')-C(6')-C(5') | 124.77(17) |
O(1)-C(6) | 1.368(2) | O(4')-C(9')-C(1') | 109.96(15) |
O(4)-C(10A) | 1.504(4) | O(4')-C(10')-C(11') | 106.46(16) |
C(10')-C(11') | 1.497(3) | O(3)-C(9)-O(4) | 124.5(2) |
C(10A)-C(11A) | 1.214(5) | C(11A)-C(10A)-O(4) | 120.2(5) |
C-H…π interactions | C-H…O interactions |
---|---|
H7B…C4´ 2.856 (x, y, 1 + z) | H8b…O2 (1-x, -y, 2 − z) 2.620 Å |
H7B…C5´ 2.862 | H4´…O3´ (1 + x, y, z) 2.680 Å |
H3…C6´ 2.888 Å | H7´1…O3 (x, y, z − 1) 2.547 Å |
H4´…C5 (1 − x, 1 − y, 2 − z) 2.881Å | H7´2…O1 (−x, −y, 1 − z) 2.654 Å |
H5…O3´ (-x, 1 − y, 2 − z) 2.498 Å |
3. Experimental Section
3.1. General
3.2. General Procedure for the Synthesis of Ethyl 2, 6-Dimethoxybenzoate (2)
3.3. Data Collection and Structure Solution
4. Conclusions
Conflict of Interest
Acknowledgments
References
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Khan, I.; Ibrar, A.; White, J.M. Ethyl 2,6-Dimethoxybenzoate: Synthesis, Spectroscopic and X-ray Crystallographic Analysis. Crystals 2012, 2, 521-527. https://doi.org/10.3390/cryst2020521
Khan I, Ibrar A, White JM. Ethyl 2,6-Dimethoxybenzoate: Synthesis, Spectroscopic and X-ray Crystallographic Analysis. Crystals. 2012; 2(2):521-527. https://doi.org/10.3390/cryst2020521
Chicago/Turabian StyleKhan, Imtiaz, Aliya Ibrar, and Jonathan M. White. 2012. "Ethyl 2,6-Dimethoxybenzoate: Synthesis, Spectroscopic and X-ray Crystallographic Analysis" Crystals 2, no. 2: 521-527. https://doi.org/10.3390/cryst2020521