Cas no 74697-15-7 (2(1H)-Pyridinone,3-ethynyl-4-hydroxy-6-methyl-)
74697-15-7 structure
Product Name:2(1H)-Pyridinone,3-ethynyl-4-hydroxy-6-methyl-
CAS No:74697-15-7
MF:C8H7NO2
MW:149.146682024002
CID:557022
PubChem ID:54731699
Update Time:2025-04-19
2(1H)-Pyridinone,3-ethynyl-4-hydroxy-6-methyl- Chemical and Physical Properties
Names and Identifiers
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- 2(1H)-Pyridinone,3-ethynyl-4-hydroxy-6-methyl-
- 2(1H)-Pyridinone, 3-ethynyl-4-hydroxy-6-methyl- (9CI)
- 3-ethynyl-4-hydroxy-6-methyl-1H-pyridin-2-one
- 74697-15-7
- 3-Ethynyl-4-hydroxy-6-methylpyridin-2(1H)-one
- DTXSID20716378
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- Inchi: 1S/C8H7NO2/c1-3-6-7(10)4-5(2)9-8(6)11/h1,4H,2H3,(H2,9,10,11)
- InChI Key: VHMFMNBINHUFNY-UHFFFAOYSA-N
- SMILES: OC1=C(C#C)C(NC(C)=C1)=O
Computed Properties
- Exact Mass: 149.047678466g/mol
- Monoisotopic Mass: 149.047678466g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 1
- Complexity: 314
- 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: 0.2
- Topological Polar Surface Area: 49.3?2
2(1H)-Pyridinone,3-ethynyl-4-hydroxy-6-methyl- Related Literature
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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