Cas no 727736-73-4 (2,6-Pyridinedicarbonitrile,3-hydroxy-)
727736-73-4 structure
Product Name:2,6-Pyridinedicarbonitrile,3-hydroxy-
CAS No:727736-73-4
MF:C7H3N3O
MW:145.118220567703
CID:559052
Update Time:2024-03-05
2,6-Pyridinedicarbonitrile,3-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 2,6-Pyridinedicarbonitrile,3-hydroxy-
- 2,6-Pyridinedicarbonitrile, 3-hydroxy- (9CI)
- 2,6-Pyridinedicarbonitrile, 3-hydroxy-
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- Inchi： 1S/C7H3N3O/c8-3-5-1-2-7(11)6(4-9)10-5/h1-2,11H
- InChI Key： FHTPODNFPDDVAC-UHFFFAOYSA-N
- SMILES： C1(C#N)=NC(C#N)=CC=C1O
Computed Properties
- Exact Mass: 145.028
- Monoisotopic Mass: 145.028
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 233
- 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: 80.7A^2
Experimental Properties
- Density: 1.44±0.1 g/cm3(Predicted)
- Boiling Point: 491.5±45.0 °C(Predicted)
- pka: -0.65±0.10(Predicted)
2,6-Pyridinedicarbonitrile,3-hydroxy- Related Literature
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
727736-73-4 (2,6-Pyridinedicarbonitrile,3-hydroxy-) Related Products
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