Cas no 846551-86-8 (1-Cyclohexyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid)
846551-86-8 structure
Product Name:1-Cyclohexyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid
CAS No:846551-86-8
MF:C12H15NO3
MW:221.252403497696
CID:2120624
Update Time:2023-08-04
1-Cyclohexyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
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- 1-cyclohexyl-1,6-dihydro-6-oxo-3-Pyridinecarboxylic acid
- XWRXRROAIDLLKW-UHFFFAOYSA-N
- 1-Cyclohexyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid
- 3-Pyridinecarboxylicacid,1-cyclohexyl-1,6-dihydro-6-oxo-
- 3-Pyridinecarboxylic acid, 1-cyclohexyl-1,6-dihydro-6-oxo-
-
- Inchi： 1S/C12H15NO3/c14-11-7-6-9(12(15)16)8-13(11)10-4-2-1-3-5-10/h6-8,10H,1-5H2,(H,15,16)
- InChI Key： XWRXRROAIDLLKW-UHFFFAOYSA-N
- SMILES： O=C1C=CC(C(=O)O)=CN1C1CCCCC1
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 365
- Topological Polar Surface Area: 57.6
1-Cyclohexyl-6-oxo-1,6-dihydropyridine-3-carboxylic acid Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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2. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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