Cas no 918339-65-8 (4-Bromo-1-(3-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole)
918339-65-8 structure
Product Name:4-Bromo-1-(3-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole
CAS No:918339-65-8
MF:C10H5BrClF3N2
MW:325.512310743332
CID:777356
Update Time:2023-08-03
4-Bromo-1-(3-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazole, 4-bromo-1-(3-chlorophenyl)-5-(trifluoromethyl)-
- 4-bromo-1-(3-chlorophenyl)-5-(trifluoromethyl)pyrazole
- 4-Bromo-1-(3-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole
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- Inchi： 1S/C10H5BrClF3N2/c11-8-5-16-17(9(8)10(13,14)15)7-3-1-2-6(12)4-7/h1-5H
- InChI Key： LCPNNWBUOLGLHG-UHFFFAOYSA-N
- SMILES： BrC1C=NN(C2C=CC=C(C=2)Cl)C=1C(F)(F)F
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 277
- Topological Polar Surface Area: 17.8
4-Bromo-1-(3-chlorophenyl)-5-(trifluoromethyl)-1H-pyrazole Related Literature
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David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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