Cas no 484-88-8 (6-chloro-2-hydroxy-1-methyl-4-oxo-1,4-dihydropyridine-3-carbonitrile)
484-88-8 structure
Product Name:6-chloro-2-hydroxy-1-methyl-4-oxo-1,4-dihydropyridine-3-carbonitrile
CAS No:484-88-8
MF:C7H5ClN2O2
MW:184.579800367355
CID:1518655
PubChem ID:54693683
Update Time:2025-04-21
6-chloro-2-hydroxy-1-methyl-4-oxo-1,4-dihydropyridine-3-carbonitrile Chemical and Physical Properties
Names and Identifiers
-
- 6-chloro-2-hydroxy-1-methyl-4-oxo-1,4-dihydropyridine-3-carbonitrile
- 6-chloro-4-hydroxy-1-methyl-2-oxopyridine-3-carbonitrile
- DTXSID50197515
- 3-Pyridinecarbonitrile, 6-chloro-1,2-dihydro-4-hydroxy-1-methyl-2-oxo-
- 6-Chloro-1,2-dihydro-4-hydroxy-1-methyl-2-oxo-3-pyridinecarbonitrile
- 484-88-8
-
- Inchi: 1S/C7H5ClN2O2/c1-10-6(8)2-5(11)4(3-9)7(10)12/h2,11H,1H3
- InChI Key: RMYRPIGGHWGCBS-UHFFFAOYSA-N
- SMILES: ClC1=CC(=C(C#N)C(N1C)=O)O
Computed Properties
- Exact Mass: 184.00405
- Monoisotopic Mass: 184.003955
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 348
- 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
- Topological Polar Surface Area: 64.3
- XLogP3: 1.1
Experimental Properties
- Density: 1.55
- Boiling Point: 259.5°C at 760 mmHg
- Flash Point: 110.7°C
- Refractive Index: 1.621
- PSA: 64.33
6-chloro-2-hydroxy-1-methyl-4-oxo-1,4-dihydropyridine-3-carbonitrile Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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