Cas no 1420963-84-3 (Tert-Butyl 3-methyl-4-(pyrimidin-2-yl)piperazine-1-carboxylate)
1420963-84-3 structure
Product Name:Tert-Butyl 3-methyl-4-(pyrimidin-2-yl)piperazine-1-carboxylate
CAS No:1420963-84-3
MF:C14H22N4O2
MW:278.350082874298
CID:2117370
Update Time:2023-08-04
Tert-Butyl 3-methyl-4-(pyrimidin-2-yl)piperazine-1-carboxylate Chemical and Physical Properties
Names and Identifiers
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- tert-butyl 3-methyl-4-(pyrimidin-2-yl)piperazine-1-carboxylate
- Tert-Butyl 3-methyl-4-(pyrimidin-2-yl)piperazine-1-carboxylate
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- Inchi： 1S/C14H22N4O2/c1-11-10-17(13(19)20-14(2,3)4)8-9-18(11)12-15-6-5-7-16-12/h5-7,11H,8-10H2,1-4H3
- InChI Key： KONKFGAPICIZMZ-UHFFFAOYSA-N
- SMILES： O(C(C)(C)C)C(N1CCN(C2N=CC=CN=2)C(C)C1)=O
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 337
- Topological Polar Surface Area: 58.6
Tert-Butyl 3-methyl-4-(pyrimidin-2-yl)piperazine-1-carboxylate Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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