Cas no 939411-65-1 (1,6-Dihydro-1-(3-methylcyclohexyl)-6-oxo-3-Pyridinecarboxylic acid)
939411-65-1 structure
Product Name:1,6-Dihydro-1-(3-methylcyclohexyl)-6-oxo-3-Pyridinecarboxylic acid
CAS No:939411-65-1
MF:C13H17NO3
MW:235.278983831406
CID:2120452
Update Time:2023-08-04
1,6-Dihydro-1-(3-methylcyclohexyl)-6-oxo-3-Pyridinecarboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 1,6-dihydro-1-(3-methylcyclohexyl)-6-oxo-3-Pyridinecarboxylic acid
- SQPNLXHXFAETGO-UHFFFAOYSA-N
- 1-(3-Methylcyclohexyl)-6-oxo-1,6-dihydropyridine-3-carboxylic acid
- 3-Pyridinecarboxylic acid, 1,6-dihydro-1-(3-methylcyclohexyl)-6-oxo-
- 1,6-Dihydro-1-(3-methylcyclohexyl)-6-oxo-3-Pyridinecarboxylic acid
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- Inchi： 1S/C13H17NO3/c1-9-3-2-4-11(7-9)14-8-10(13(16)17)5-6-12(14)15/h5-6,8-9,11H,2-4,7H2,1H3,(H,16,17)
- InChI Key： SQPNLXHXFAETGO-UHFFFAOYSA-N
- SMILES： O=C1C=CC(C(=O)O)=CN1C1CCCC(C)C1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 2
- Complexity: 398
- Topological Polar Surface Area: 57.6
1,6-Dihydro-1-(3-methylcyclohexyl)-6-oxo-3-Pyridinecarboxylic acid Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
939411-65-1 (1,6-Dihydro-1-(3-methylcyclohexyl)-6-oxo-3-Pyridinecarboxylic acid) Related Products
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