Cas no 19839-30-6 (3-Pyridinecarboxylic acid, 2-chloro-4,6-dimethyl-5-nitro-)
19839-30-6 structure
Product Name:3-Pyridinecarboxylic acid, 2-chloro-4,6-dimethyl-5-nitro-
CAS No:19839-30-6
MF:C8H7ClN2O4
MW:230.605180978775
CID:1389063
Update Time:2024-08-16
3-Pyridinecarboxylic acid, 2-chloro-4,6-dimethyl-5-nitro- Chemical and Physical Properties
Names and Identifiers
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- 3-Pyridinecarboxylic acid, 2-chloro-4,6-dimethyl-5-nitro-
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- Inchi： 1S/C8H7ClN2O4/c1-3-5(8(12)13)7(9)10-4(2)6(3)11(14)15/h1-2H3,(H,12,13)
- InChI Key： VXANYRZXUFAXKK-UHFFFAOYSA-N
- SMILES： C1(Cl)=NC(C)=C([N+]([O-])=O)C(C)=C1C(O)=O
Experimental Properties
- Density: 1.521±0.06 g/cm3(Predicted)
- Melting Point: 170-171 °C(Solv: ethanol (64-17-5))
- Boiling Point: 388.8±42.0 °C(Predicted)
- pka: 1.41±0.32(Predicted)
3-Pyridinecarboxylic acid, 2-chloro-4,6-dimethyl-5-nitro- Related Literature
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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