Cas no 1192494-80-6 (2-Chloro-5-fluoro-4,6-dimethoxypyrimidine)
1192494-80-6 structure
Product Name:2-Chloro-5-fluoro-4,6-dimethoxypyrimidine
CAS No:1192494-80-6
MF:C6H6ClFN2O2
MW:192.575443744659
CID:2122040
Update Time:2023-08-04
2-Chloro-5-fluoro-4,6-dimethoxypyrimidine Chemical and Physical Properties
Names and Identifiers
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- 2-chloro-5-fluoro-4,6-dimethoxyPyrimidine
- 2-Chloro-5-fluoro-4,6-dimethoxypyrimidine
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- Inchi： 1S/C6H6ClFN2O2/c1-11-4-3(8)5(12-2)10-6(7)9-4/h1-2H3
- InChI Key： LSPBNYKEPNIXFR-UHFFFAOYSA-N
- SMILES： ClC1=NC(=C(C(=N1)OC)F)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 138
- Topological Polar Surface Area: 44.2
2-Chloro-5-fluoro-4,6-dimethoxypyrimidine Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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