Cas no 143411-84-1 (2-Piperazinecarboxaldehyde,3,6-dioxo-)
143411-84-1 structure
Product Name:2-Piperazinecarboxaldehyde,3,6-dioxo-
CAS No:143411-84-1
MF:C5H6N2O3
MW:142.1127409935
CID:108330
PubChem ID:15646789
Update Time:2025-04-18
2-Piperazinecarboxaldehyde,3,6-dioxo- Chemical and Physical Properties
Names and Identifiers
-
- 2-Piperazinecarboxaldehyde,3,6-dioxo-
- CS-0046479
- 3,6-Dioxopiperazine-2-carbaldehyde
- SCHEMBL9186967
- 2-Piperazinecarboxaldehyde, 3,6-dioxo- (9CI)
- 143411-84-1
-
- Inchi: 1S/C5H6N2O3/c8-2-3-5(10)6-1-4(9)7-3/h2-3H,1H2,(H,6,10)(H,7,9)
- InChI Key: DWSCUWDVACJAAE-UHFFFAOYSA-N
- SMILES: O=C1C(C=O)NC(CN1)=O
Computed Properties
- Exact Mass: 142.03788
- Monoisotopic Mass: 142.03784206g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 189
- 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
- XLogP3: -1.6
- Topological Polar Surface Area: 75.3?2
Experimental Properties
- PSA: 75.27
2-Piperazinecarboxaldehyde,3,6-dioxo- Related Literature
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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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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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
143411-84-1 (2-Piperazinecarboxaldehyde,3,6-dioxo-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
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- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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