Cas no 37780-79-3 (4-[2-(2-benzofuryl)vinyl]benzonitrile)
![4-[2-(2-benzofuryl)vinyl]benzonitrile structure](https://ossimg.kuujia.com/scimg/38000/37780-79-3x500.png)
37780-79-3 structure
Product Name:4-[2-(2-benzofuryl)vinyl]benzonitrile
CAS No:37780-79-3
MF:C17H11NO
MW:245.275344133377
CID:922617
PubChem ID:169964
Update Time:2025-04-19
4-[2-(2-benzofuryl)vinyl]benzonitrile Chemical and Physical Properties
Names and Identifiers
-
- 4-[2-(2-benzofuryl)vinyl]benzonitrile
- 4-[(E)-2-(1-benzofuran-2-yl)ethenyl]benzonitrile
- 4-(2-(2-Benzofuryl)vinyl)benzonitrile
- Benzonitrile, 4-(2-(2-benzofuranyl)ethenyl)-
- NS00030295
- Benzonitrile, 4-[2-(2-benzofuranyl)ethenyl]-
- DTXSID7068051
- 37780-79-3
-
- Inchi： 1S/C17H11NO/c18-12-14-7-5-13(6-8-14)9-10-16-11-15-3-1-2-4-17(15)19-16/h1-11H
- InChI Key： CXNNRNMUZUHBDI-UHFFFAOYSA-N
- SMILES： O1C(C=CC2C=CC(C#N)=CC=2)=CC2C=CC=CC1=2
Computed Properties
- Exact Mass: 245.08413
- Monoisotopic Mass: 245.084063974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 372
- 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: 4.3
- Topological Polar Surface Area: 36.9?2
Experimental Properties
- PSA: 36.93
4-[2-(2-benzofuryl)vinyl]benzonitrile Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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