Cas no 58619-57-1 (1,4-Piperazinediacetonitrile,2-methyl-(9CI))
58619-57-1 structure
Product Name:1,4-Piperazinediacetonitrile,2-methyl-(9CI)
CAS No:58619-57-1
MF:C9H14N4
MW:178.234261035919
CID:851634
Update Time:2023-11-19
1,4-Piperazinediacetonitrile,2-methyl-(9CI) Chemical and Physical Properties
Names and Identifiers
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- 1,4-Piperazinediacetonitrile,2-methyl-(9CI)
- 2-(3-METHYLPIPERAZIN-1-YL)PYRIMIDINE
- 2-METHYL-1,4-PIPERAZINEDIACETONITRILE
- 2-[4-(cyanomethyl)-3-methylpiperazin-1-yl]acetonitrile
- CID 45099722
- 1,4-Piperazinediacetonitrile, 2-methyl-
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- Inchi： 1S/C9H14N4/c1-9-8-12(4-2-10)6-7-13(9)5-3-11/h9H,4-8H2,1H3
- InChI Key： FUEDQQHTMWITRL-UHFFFAOYSA-N
- SMILES： N1(CC#N)CCN(CC#N)CC1C
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 255
- Topological Polar Surface Area: 54.1
1,4-Piperazinediacetonitrile,2-methyl-(9CI) Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
58619-57-1 (1,4-Piperazinediacetonitrile,2-methyl-(9CI)) Related Products
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