Cas no 5768-12-7 (2,4,6-Piperidinetrione(9CI))
2,4,6-Piperidinetrione(9CI) structure
Product Name:2,4,6-Piperidinetrione(9CI)
2,4,6-Piperidinetrione(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2,4,6-Piperidinetrione(9CI)
- 2,4,6-PIPERIDINETRIONE
- 5768-12-7
- SCHEMBL3164754
- DTXSID60330375
- piperidine-2,4,6-trione
-
- Inchi： 1S/C5H5NO3/c7-3-1-4(8)6-5(9)2-3/h1-2H2,(H,6,8,9)
- InChI Key： QQNAAOIGTOESQU-UHFFFAOYSA-N
- SMILES： O=C1CC(NC(C1)=O)=O
Computed Properties
- Exact Mass: 127.02700
- Monoisotopic Mass: 127.026943022g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 167
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.8
- Topological Polar Surface Area: 63.2?2
Experimental Properties
- PSA: 63.24000
- LogP: -0.67910
2,4,6-Piperidinetrione(9CI) Related Literature
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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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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