Cas no 2809-49-6 (1-Piperidinebutanenitrile,a-ethyl-a-phenyl-)
2809-49-6 structure
Product Name:1-Piperidinebutanenitrile,a-ethyl-a-phenyl-
1-Piperidinebutanenitrile,a-ethyl-a-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Piperidinebutanenitrile,a-ethyl-a-phenyl-
- 2-ethyl-2-phenyl-4-piperidin-1-ylbutanenitrile
- 2-Aethyl-2-phenyl-4-piperidino-butyronitril
- 2-ethyl-2-phenyl-4-piperidino-butyronitrile
- 2-Phenyl-2-(2-piperidinoethyl)butyronitrile
- 3-cyano-3-phenyl-5-(1-piperidino)-pentane
- AC1L2AMT
- BRN 0023171
- BUTYRONITRILE, 2-PHENYL-2-(2-PIPERIDINOETHYL)-
- CTK8H9862
- LS-48271
- 2-ETHYL-2-PHENYL-4-(PIPERIDIN-1-YL)BUTANENITRILE
- 4-20-00-01089 (Beilstein Handbook Reference)
- 2809-49-6
- DTXSID30950822
- SCHEMBL11649850
-
- Inchi: 1S/C17H24N2/c1-2-17(15-18,16-9-5-3-6-10-16)11-14-19-12-7-4-8-13-19/h3,5-6,9-10H,2,4,7-8,11-14H2,1H3
- InChI Key: FMLRYJANQCJZDM-UHFFFAOYSA-N
- SMILES: N1(CCCCC1)CCC(C#N)(C1C=CC=CC=1)CC
Computed Properties
- Exact Mass: 256.19412
- Monoisotopic Mass: 256.193949
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 5
- Complexity: 305
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 27
- XLogP3: 3.6
Experimental Properties
- Density: 1.001
- Boiling Point: 400.2°Cat760mmHg
- Flash Point: 167.8°C
- Refractive Index: 1.524
- PSA: 27.03
1-Piperidinebutanenitrile,a-ethyl-a-phenyl- Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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