Cas no 823227-38-9 (Benzonitrile, 2-[[2-(3-pyridinylethynyl)phenyl]ethynyl]-)
![Benzonitrile, 2-[[2-(3-pyridinylethynyl)phenyl]ethynyl]- structure](https://ossimg.kuujia.com/scimg/823500/823227-38-9x500.png)
823227-38-9 structure
Product Name:Benzonitrile, 2-[[2-(3-pyridinylethynyl)phenyl]ethynyl]-
CAS No:823227-38-9
MF:C22H12N2
MW:304.344084739685
CID:694167
PubChem ID:71419223
Update Time:2025-04-19
Benzonitrile, 2-[[2-(3-pyridinylethynyl)phenyl]ethynyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 2-[[2-(3-pyridinylethynyl)phenyl]ethynyl]-
- 2-[2-[2-(2-pyridin-3-ylethynyl)phenyl]ethynyl]benzonitrile
- 2-({2-[(Pyridin-3-yl)ethynyl]phenyl}ethynyl)benzonitrile
- 823227-38-9
- DTXSID90838490
-
- Inchi： 1S/C22H12N2/c23-16-22-10-4-3-9-21(22)14-13-20-8-2-1-7-19(20)12-11-18-6-5-15-24-17-18/h1-10,15,17H
- InChI Key： MDHHGPMAQFIVSH-UHFFFAOYSA-N
- SMILES： N1C=CC=C(C=1)C#CC1=CC=CC=C1C#CC1C=CC=CC=1C#N
Computed Properties
- Exact Mass: 304.100048391g/mol
- Monoisotopic Mass: 304.100048391g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 24
- Rotatable Bond Count: 4
- Complexity: 598
- 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: 4.6
- Topological Polar Surface Area: 36.7?2
Benzonitrile, 2-[[2-(3-pyridinylethynyl)phenyl]ethynyl]- Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
823227-38-9 (Benzonitrile, 2-[[2-(3-pyridinylethynyl)phenyl]ethynyl]-) Related Products
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