Cas no 88491-78-5 (Pyridine, 3,5-dinitro-, compd. with pyridine (2:1))
88491-78-5 structure
Product Name:Pyridine, 3,5-dinitro-, compd. with pyridine (2:1)
CAS No:88491-78-5
MF:C15H11N7O8
MW:417.289942026138
CID:630692
PubChem ID:71318347
Update Time:2025-04-19
Pyridine, 3,5-dinitro-, compd. with pyridine (2:1) Chemical and Physical Properties
Names and Identifiers
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- Pyridine, 3,5-dinitro-, compd. with pyridine (2:1)
- 3,5-dinitropyridine,pyridine
- 88491-78-5
- 3,5-Dinitropyridine--pyridine (2/1)
- DTXSID70748482
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- Inchi： 1S/2C5H3N3O4.C5H5N/c2*9-7(10)4-1-5(8(11)12)3-6-2-4;1-2-4-6-5-3-1/h2*1-3H;1-5H
- InChI Key： VGVZNYGADOYSPX-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=NC=C(C=1)[N+](=O)[O-])=O.[O-][N+](C1C=NC=C(C=1)[N+](=O)[O-])=O.N1C=CC=CC=1
Computed Properties
- Exact Mass: 417.06691033g/mol
- Monoisotopic Mass: 417.06691033g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 11
- Heavy Atom Count: 30
- Rotatable Bond Count: 0
- Complexity: 207
- Covalently-Bonded Unit Count: 3
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 222?2
Pyridine, 3,5-dinitro-, compd. with pyridine (2:1) Related Literature
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1. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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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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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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5. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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