Cas no 395101-80-1 (1H-Indazole-5-carbonitrile, 3-(2-naphthalenyl)-)
395101-80-1 structure
Product Name:1H-Indazole-5-carbonitrile, 3-(2-naphthalenyl)-
CAS No:395101-80-1
MF:C18H11N3
MW:269.300043344498
CID:1509075
Update Time:2024-08-24
1H-Indazole-5-carbonitrile, 3-(2-naphthalenyl)- Chemical and Physical Properties
Names and Identifiers
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- 1H-Indazole-5-carbonitrile, 3-(2-naphthalenyl)-
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- Inchi： 1S/C18H11N3/c19-11-12-5-8-17-16(9-12)18(21-20-17)15-7-6-13-3-1-2-4-14(13)10-15/h1-10H,(H,20,21)
- InChI Key： HPOAXTLOXYLCFJ-UHFFFAOYSA-N
- SMILES： N1C2=C(C=C(C#N)C=C2)C(C2=CC=C3C(=C2)C=CC=C3)=N1
Computed Properties
- Exact Mass: 269.09543
Experimental Properties
- Density: 1.34±0.1 g/cm3(Predicted)
- Boiling Point: 549.5±35.0 °C(Predicted)
- PSA: 52.47
- pka: 11.74±0.40(Predicted)
1H-Indazole-5-carbonitrile, 3-(2-naphthalenyl)- Related Literature
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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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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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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