Cas no 190834-40-3 (2-Propenal, 3-(2-quinolinyl)-)
2-Propenal, 3-(2-quinolinyl)- structure
Product Name:2-Propenal, 3-(2-quinolinyl)-
CAS No:190834-40-3
MF:C12H9NO
MW:183.205962896347
CID:1384685
PubChem ID:513391
Update Time:2025-04-20
2-Propenal, 3-(2-quinolinyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2-Propenal, 3-(2-quinolinyl)-
- 3-quinolin-2-ylprop-2-enal
- AKOS017883926
- 190834-40-3
- DTXSID10333598
-
- Inchi： 1S/C12H9NO/c14-9-3-5-11-8-7-10-4-1-2-6-12(10)13-11/h1-9H
- InChI Key： DIEFKJUFJHCQEE-UHFFFAOYSA-N
- SMILES： O=CC=CC1=CC=C2C=CC=CC2=N1
Computed Properties
- Exact Mass: 183.06847
- Monoisotopic Mass: 183.068413911g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 224
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 1
- XLogP3: 2.1
- Topological Polar Surface Area: 30?2
Experimental Properties
- PSA: 29.96
2-Propenal, 3-(2-quinolinyl)- Related Literature
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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