Cas no 234-61-7 (Imidazo[5,1-a]isoquinoline)
![Imidazo[5,1-a]isoquinoline structure](https://ossimg.kuujia.com/scimg/500/234-61-7x500.png)
Imidazo[5,1-a]isoquinoline structure
Product Name:Imidazo[5,1-a]isoquinoline
CAS No:234-61-7
MF:C11H8N2
MW:168.194622039795
CID:277102
PubChem ID:12243104
Update Time:2025-04-19
Imidazo[5,1-a]isoquinoline Chemical and Physical Properties
Names and Identifiers
-
- Imidazo[5,1-a]isoquinoline
- Benzglyoxalocoline
- Benzoglyoxalocoline
- BDBM50516658
- AKOS006372978
- 234-61-7
- CHEMBL4437180
- DTXSID40482063
- SCHEMBL1502341
-
- Inchi： 1S/C11H8N2/c1-2-4-10-9(3-1)5-6-13-8-12-7-11(10)13/h1-8H
- InChI Key： ZAVXICQEZRMZHE-UHFFFAOYSA-N
- SMILES： N12C=NC=C1C1C=CC=CC=1C=C2
Computed Properties
- Exact Mass: 168.06884
- Monoisotopic Mass: 168.068748264g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 0
- Complexity: 193
- 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
- XLogP3: 3.1
- Topological Polar Surface Area: 17.3?2
Experimental Properties
- PSA: 17.3
Imidazo[5,1-a]isoquinoline Related Literature
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Haosheng Li,Mingjing Mei,Duozhi Wang,Lei Zhou Org. Chem. Front. 2023 10 1544
-
Ya-Nan Tian,Shihai Lv,Lingyu Huang,Chaoying Wen,Yanyan Yang,Xiangfei Kong,Qiping Zhu,Shiqing Li Org. Chem. Front. 2023 10 83
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3. Polycyclic N-heterocyclic compounds. Part 52.1 One-step syntheses of imidazo[1,5-a]pyridines, imidazo[1,5-a]quinolines and imidazo[5,1-a]isoquinolines by Vilsmeier reactions of pyridine-2-carbonitriles, quinoline-2-carbonitriles and isoquinoline-1-carbonitrilesKenji Sasaki,Akifumi Tsurumori,Takashi Hirota J. Chem. Soc. Perkin Trans. 1 1998 3851
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Vijayalaxmi Amareshwar,Nimesh C. Mishra,Hiriyakkanavar Ila Org. Biomol. Chem. 2011 9 5793
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5. 669. Synthesis and oxidation of some 1-benzylisoquinoline derivativesI. Baxter,L. T. Allan,G. A. Swan J. Chem. Soc. 1965 3645
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