Cas no 395102-06-4 (1H-Indazole-5-carbonitrile, 3-(phenylethynyl)-)
395102-06-4 structure
Product Name:1H-Indazole-5-carbonitrile, 3-(phenylethynyl)-
CAS No:395102-06-4
MF:C16H9N3
MW:243.262762784958
CID:1514278
Update Time:2024-08-24
1H-Indazole-5-carbonitrile, 3-(phenylethynyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Indazole-5-carbonitrile, 3-(phenylethynyl)-
- 1H-Indazole-5-carbonitrile, 3-(2-phenylethynyl)-
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- Inchi： 1S/C16H9N3/c17-11-13-7-9-16-14(10-13)15(18-19-16)8-6-12-4-2-1-3-5-12/h1-5,7,9-10H,(H,18,19)
- InChI Key： NJYQBGDZLIGADD-UHFFFAOYSA-N
- SMILES： N1C2=C(C=C(C#N)C=C2)C(C#CC2=CC=CC=C2)=N1
Computed Properties
- Exact Mass: 243.07977
Experimental Properties
- Density: 1.33±0.1 g/cm3(Predicted)
- Boiling Point: 509.3±30.0 °C(Predicted)
- PSA: 52.47
- pka: 11.41±0.40(Predicted)
1H-Indazole-5-carbonitrile, 3-(phenylethynyl)- Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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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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