Cas no 98484-48-1 (2-Piperidinecarboxamide,6-oxo-)
98484-48-1 structure
Product Name:2-Piperidinecarboxamide,6-oxo-
CAS No:98484-48-1
MF:C6H10N2O2
MW:142.155801296234
CID:801831
Update Time:2024-02-01
2-Piperidinecarboxamide,6-oxo- Chemical and Physical Properties
Names and Identifiers
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- 2-Piperidinecarboxamide,6-oxo-
- 2-Piperidinecarboxamide,6-oxo-(6CI,9CI)
- 6-oxo-piperidine-2-carboxylic acid amide
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- Inchi： 1S/C6H10N2O2/c7-6(10)4-2-1-3-5(9)8-4/h4H,1-3H2,(H2,7,10)(H,8,9)
- InChI Key： YMYYDZATGKEEBG-UHFFFAOYSA-N
- SMILES： N1C(=O)CCCC1C(N)=O
Computed Properties
- Exact Mass: 142.07400
- Monoisotopic Mass: 142.074
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 1
- Complexity: 167
- 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: 72.2A^2
Experimental Properties
- PSA: 72.19000
- LogP: 0.16950
2-Piperidinecarboxamide,6-oxo- Related Literature
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
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