Cas no 115122-79-7 (2,5,6,7-tetrahydro-2-oxo-1H-Cyclopenta[b]pyridine-4-carboxylic acid)
![2,5,6,7-tetrahydro-2-oxo-1H-Cyclopenta[b]pyridine-4-carboxylic acid structure](https://ossimg.kuujia.com/scimg/115500/115122-79-7x500.png)
115122-79-7 structure
Product Name:2,5,6,7-tetrahydro-2-oxo-1H-Cyclopenta[b]pyridine-4-carboxylic acid
CAS No:115122-79-7
MF:C9H9NO3
MW:179.172662496567
CID:1099864
PubChem ID:15840553
Update Time:2025-04-20
2,5,6,7-tetrahydro-2-oxo-1H-Cyclopenta[b]pyridine-4-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- 2,5,6,7-tetrahydro-2-oxo-1H-Cyclopenta[b]pyridine-4-carboxylic acid
- 115122-79-7
- CHEMBL2048373
- MFCD19690397
- SY364839
- 2-oxo-2,5,6,7-tetrahydro-1h-cyclopenta[b]pyridine-4-carboxylic acid
- SCHEMBL8643035
-
- Inchi： 1S/C9H9NO3/c11-8-4-6(9(12)13)5-2-1-3-7(5)10-8/h4H,1-3H2,(H,10,11)(H,12,13)
- InChI Key： VJWZPFRDVGCOOZ-UHFFFAOYSA-N
- SMILES： O=C1C=C(C(=O)O)C2=C(CCC2)N1
Computed Properties
- Exact Mass: 179.058243149g/mol
- Monoisotopic Mass: 179.058243149g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 352
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.3
- Topological Polar Surface Area: 66.4?2
2,5,6,7-tetrahydro-2-oxo-1H-Cyclopenta[b]pyridine-4-carboxylic acid Related Literature
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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5. 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
115122-79-7 (2,5,6,7-tetrahydro-2-oxo-1H-Cyclopenta[b]pyridine-4-carboxylic acid) Related Products
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