Cas no 342601-67-6 (Tert-Butyl 3-(pyridin-2-yl)acrylate)
342601-67-6 structure
Product Name:Tert-Butyl 3-(pyridin-2-yl)acrylate
CAS No:342601-67-6
MF:C12H15NO2
MW:205.253003358841
CID:852727
Update Time:2023-08-02
Tert-Butyl 3-(pyridin-2-yl)acrylate Chemical and Physical Properties
Names and Identifiers
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- tert-Butyl (2E)-3-(pyridin-2-yl)prop-2-enoate
- tert-butyl 3-pyridin-2-ylprop-2-enoate
- tert-Butyl 3-(pyridin-2-yl)acrylate
- Tert-butyl (E)-3-pyridin-2-ylprop-2-enoate
- 2-Propenoic acid, 3-(2-pyridinyl)-, 1,1-dimethylethyl ester, (2E)-
- Tert-Butyl 3-(pyridin-2-yl)acrylate
-
- Inchi： 1S/C12H15NO2/c1-12(2,3)15-11(14)8-7-10-6-4-5-9-13-10/h4-9H,1-3H3
- InChI Key： TWSFUBIWTCVJEH-UHFFFAOYSA-N
- SMILES： O(C(C=CC1C=CC=CN=1)=O)C(C)(C)C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 241
- Topological Polar Surface Area: 39.2
Tert-Butyl 3-(pyridin-2-yl)acrylate Related Literature
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Yu Long,Bing Yuan,Jianrui Niu,Xin Tong,Jiantai Ma New J. Chem., 2015,39, 1179-1185
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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