Cas no 182306-64-5 (Ethanone,1-(5-propyl-2-pyrazinyl)-)
182306-64-5 structure
Product Name:Ethanone,1-(5-propyl-2-pyrazinyl)-
CAS No:182306-64-5
MF:C9H12N2O
MW:164.204381942749
CID:113830
PubChem ID:45086306
Update Time:2025-04-18
Ethanone,1-(5-propyl-2-pyrazinyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone,1-(5-propyl-2-pyrazinyl)-
- Ethanone, 1-(5-propylpyrazinyl)- (9CI)
- 182306-64-5
- 1-(5-Propylpyrazin-2-yl)ethanone
-
- Inchi: 1S/C9H12N2O/c1-3-4-8-5-11-9(6-10-8)7(2)12/h5-6H,3-4H2,1-2H3
- InChI Key: OVBCDIBDTCYEDW-UHFFFAOYSA-N
- SMILES: O=C(C)C1=CN=C(C=N1)CCC
Computed Properties
- Exact Mass: 164.09506
- Monoisotopic Mass: 164.095
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 159
- 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: 42.8A^2
- XLogP3: 1
Experimental Properties
- PSA: 42.85
Ethanone,1-(5-propyl-2-pyrazinyl)- Related Literature
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Hailing Chen,Lu Yin,Meng Liu,Laibing Wang,Michiya Fujiki,Wei Zhang RSC Adv., 2019,9, 4849-4856
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
182306-64-5 (Ethanone,1-(5-propyl-2-pyrazinyl)-) Related Products
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