Cas no 140616-30-4 (1-Piperazinecarboxylic acid, 4-(2-fluoro-5-nitrophenyl)-, ethyl ester)
140616-30-4 structure
Product Name:1-Piperazinecarboxylic acid, 4-(2-fluoro-5-nitrophenyl)-, ethyl ester
CAS No:140616-30-4
MF:C13H16FN3O4
MW:297.282246589661
CID:1294505
Update Time:2024-08-04
1-Piperazinecarboxylic acid, 4-(2-fluoro-5-nitrophenyl)-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- 1-Piperazinecarboxylic acid, 4-(2-fluoro-5-nitrophenyl)-, ethyl ester
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- Inchi： 1S/C13H16FN3O4/c1-2-21-13(18)16-7-5-15(6-8-16)12-9-10(17(19)20)3-4-11(12)14/h3-4,9H,2,5-8H2,1H3
- InChI Key： FCPZGJHARBTONF-UHFFFAOYSA-N
- SMILES： N1(C(OCC)=O)CCN(C2=CC([N+]([O-])=O)=CC=C2F)CC1
Computed Properties
- Exact Mass: 297.11258
Experimental Properties
- Density: 1.333±0.06 g/cm3(Predicted)
- Boiling Point: 431.6±45.0 °C(Predicted)
- PSA: 75.92
- pka: 0.39±0.70(Predicted)
1-Piperazinecarboxylic acid, 4-(2-fluoro-5-nitrophenyl)-, ethyl ester Related Literature
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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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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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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