Cas no 84619-09-0 (2-Amino-4,6-dimethyl-5-phenylpyridine-3-carboxylic acid)
84619-09-0 structure
Product Name:2-Amino-4,6-dimethyl-5-phenylpyridine-3-carboxylic acid
CAS No:84619-09-0
MF:C14H14N2O2
MW:242.273163318634
CID:666673
Update Time:2023-08-03
2-Amino-4,6-dimethyl-5-phenylpyridine-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 3-Pyridinecarboxylic acid, 2-amino-4,6-dimethyl-5-phenyl-
- 2-amino-4,6-dimethyl-5-phenylpyridine-3-carboxylic acid
- YBMOQMLSFLUXTD-UHFFFAOYSA-N
- 2-AMINO-4,6-DIMETHYL-5-PHENYL-3-PYRIDINECARBOXYLIC ACID
- 2-Amino-4,6-dimethyl-5-phenylpyridine-3-carboxylic acid
-
- Inchi： 1S/C14H14N2O2/c1-8-11(10-6-4-3-5-7-10)9(2)16-13(15)12(8)14(17)18/h3-7H,1-2H3,(H2,15,16)(H,17,18)
- InChI Key： YBMOQMLSFLUXTD-UHFFFAOYSA-N
- SMILES： OC(C1=C(N)N=C(C)C(C2C=CC=CC=2)=C1C)=O
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 302
- Topological Polar Surface Area: 76.2
2-Amino-4,6-dimethyl-5-phenylpyridine-3-carboxylic acid Related Literature
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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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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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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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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
84619-09-0 (2-Amino-4,6-dimethyl-5-phenylpyridine-3-carboxylic acid) Related Products
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