Cas no 614731-77-0 (4-Tert-butoxypyrimidine-5-carboxaldehyde)
614731-77-0 structure
Product Name:4-Tert-butoxypyrimidine-5-carboxaldehyde
CAS No:614731-77-0
MF:C9H12N2O2
MW:180.203782081604
CID:1021732
Update Time:2023-08-02
4-Tert-butoxypyrimidine-5-carboxaldehyde Chemical and Physical Properties
Names and Identifiers
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- 5-Pyrimidinecarboxaldehyde,4-(1,1-dimethylethoxy)-(9CI)
- 4-[(2-methylpropan-2-yl)oxy]pyrimidine-5-carbaldehyde
- AMGIXQYSELDPDF-UHFFFAOYSA-N
- 4-tert-butoxypyrimidine-5-carboxaldehyde
- 4-(tert-Butoxy)pyrimidine-5-carbaldehyde
- 5-pyrimidinecarbaldehyde,4-(1,1-dimethylethoxy)-
- 5-Pyrimidinecarboxaldehyde, 4-(1,1-dimethylethoxy)-
- 4-Tert-butoxypyrimidine-5-carboxaldehyde
-
- Inchi： 1S/C9H12N2O2/c1-9(2,3)13-8-7(5-12)4-10-6-11-8/h4-6H,1-3H3
- InChI Key： AMGIXQYSELDPDF-UHFFFAOYSA-N
- SMILES： O(C1C(C=O)=CN=CN=1)C(C)(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 177
- Topological Polar Surface Area: 52.1
4-Tert-butoxypyrimidine-5-carboxaldehyde Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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