Cas no 171817-45-1 (1H-Pyrazole, 3-(9-anthracenyl)-5-methyl-)
171817-45-1 structure
Product Name:1H-Pyrazole, 3-(9-anthracenyl)-5-methyl-
CAS No:171817-45-1
MF:C18H14N2
MW:258.317163944244
CID:1354469
Update Time:2024-08-17
1H-Pyrazole, 3-(9-anthracenyl)-5-methyl- Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazole, 3-(9-anthracenyl)-5-methyl-
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- Inchi： 1S/C18H14N2/c1-12-10-17(20-19-12)18-15-8-4-2-6-13(15)11-14-7-3-5-9-16(14)18/h2-11H,1H3,(H,19,20)
- InChI Key： CXAQRTXKNCZXTJ-UHFFFAOYSA-N
- SMILES： N1C(C)=CC(C2C3=CC=CC=C3C=C3C=2C=CC=C3)=N1
Computed Properties
- Exact Mass: 258.11582
Experimental Properties
- Density: 1.225±0.06 g/cm3(Predicted)
- Melting Point: >300 °C(Solv: ethanol (64-17-5))
- Boiling Point: 465.0±14.0 °C(Predicted)
- PSA: 28.68
- pka: 13.91±0.10(Predicted)
1H-Pyrazole, 3-(9-anthracenyl)-5-methyl- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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