Cas no 776295-01-3 (2-Piperidinecarboxamide,5-amino-6-oxo-)
776295-01-3 structure
Product Name:2-Piperidinecarboxamide,5-amino-6-oxo-
CAS No:776295-01-3
MF:C6H11N3O2
MW:157.170440912247
CID:552817
Update Time:2024-01-30
2-Piperidinecarboxamide,5-amino-6-oxo- Chemical and Physical Properties
Names and Identifiers
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- 2-Piperidinecarboxamide,5-amino-6-oxo-
- 2-Piperidinecarboxamide, 5-amino-6-oxo- (9CI)
- 2-Piperidinecarboxamide, 5-amino-6-oxo-
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- Inchi： 1S/C6H11N3O2/c7-3-1-2-4(5(8)10)9-6(3)11/h3-4H,1-2,7H2,(H2,8,10)(H,9,11)
- InChI Key： YNFDICGMSACCDY-UHFFFAOYSA-N
- SMILES： N1C(=O)C(N)CCC1C(N)=O
Computed Properties
- Exact Mass: 157.085
- Monoisotopic Mass: 157.085
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 192
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 98.2A^2
Experimental Properties
- Density: 1.257±0.06 g/cm3(Predicted)
- Boiling Point: 528.4±50.0 °C(Predicted)
- pka: 14.34±0.60(Predicted)
2-Piperidinecarboxamide,5-amino-6-oxo- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Bruce Parkinson Energy Environ. Sci., 2010,3, 509-511
776295-01-3 (2-Piperidinecarboxamide,5-amino-6-oxo-) Related Products
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- 19889-77-1(Piperidine-2-carboxamide)
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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