Cas no 88757-62-4 (Propanenitrile, 2-[(5-nitro-8-quinolinyl)oxy]-)
![Propanenitrile, 2-[(5-nitro-8-quinolinyl)oxy]- structure](https://ossimg.kuujia.com/scimg/89000/88757-62-4x500.png)
88757-62-4 structure
Product Name:Propanenitrile, 2-[(5-nitro-8-quinolinyl)oxy]-
CAS No:88757-62-4
MF:C12H9N3O3
MW:243.218162298203
CID:622170
PubChem ID:71320017
Update Time:2025-04-19
Propanenitrile, 2-[(5-nitro-8-quinolinyl)oxy]- Chemical and Physical Properties
Names and Identifiers
-
- Propanenitrile, 2-[(5-nitro-8-quinolinyl)oxy]-
- 2-(5-nitroquinolin-8-yl)oxypropanenitrile
- DTXSID70749999
- 88757-62-4
- 2-[(5-Nitroquinolin-8-yl)oxy]propanenitrile
-
- Inchi： 1S/C12H9N3O3/c1-8(7-13)18-11-5-4-10(15(16)17)9-3-2-6-14-12(9)11/h2-6,8H,1H3
- InChI Key： JBMMORIKDLIJDG-UHFFFAOYSA-N
- SMILES： O(C(C#N)C)C1=CC=C(C2=CC=CN=C21)[N+](=O)[O-]
Computed Properties
- Exact Mass: 243.06439116g/mol
- Monoisotopic Mass: 243.06439116g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 359
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.2
- Topological Polar Surface Area: 91.7?2
Propanenitrile, 2-[(5-nitro-8-quinolinyl)oxy]- Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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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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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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