Cas no 808764-25-2 (1-Acetyl-4-bromo-3(5)-trifluoromethyl-5(3)-phenylpyrazole)
808764-25-2 structure
Product Name:1-Acetyl-4-bromo-3(5)-trifluoromethyl-5(3)-phenylpyrazole
CAS No:808764-25-2
MF:C12H8BrF3N2O
MW:333.103932380676
CID:1004365
PubChem ID:2756269
Update Time:2025-04-20
1-Acetyl-4-bromo-3(5)-trifluoromethyl-5(3)-phenylpyrazole Chemical and Physical Properties
Names and Identifiers
-
- 1-Acetyl-4-bromo-3(5)-trifluoromethyl-5(3)-phenylpyrazole
- 1-[4-Bromo-5-phenyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone
- 1-ACETYL-4-BROMO-5(3)-PHENYL-3(5)-TRIFLUOROMETHYLPYRAZOLE
- AKOS007930734
- 1-Acetyl-4-bromo-3(5)-trifluoromethyl-5(3)-(phenyl)pyrazole
- 1-(4-bromo-5-phenyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)ethanone
- 1-[4-bromo-5-phenyl-3-(trifluoromethyl)pyrazol-1-yl]ethanone
- 1-Acetyl-4-bromo-5(3)-phenyl-3(5)-(trifluoromethyl)pyrazole
- 808764-25-2
- 231955-60-5
- 1-(4-Bromo-5-phenyl-3-(trifluoromethyl)-1H-pyrazol-1-yl)ethan-1-one
- 1-Acetyl-4-bromo-5-phenyl-3-(trifluoromethyl)pyrazole
-
- Inchi: 1S/C12H8BrF3N2O/c1-7(19)18-10(8-5-3-2-4-6-8)9(13)11(17-18)12(14,15)16/h2-6H,1H3
- InChI Key: HIKPALQVTURLLD-UHFFFAOYSA-N
- SMILES: BrC1C(C(F)(F)F)=NN(C(C)=O)C=1C1C=CC=CC=1
Computed Properties
- Exact Mass: 331.97721g/mol
- Monoisotopic Mass: 331.97721g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 1
- Complexity: 344
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.4
- Topological Polar Surface Area: 34.9?2
1-Acetyl-4-bromo-3(5)-trifluoromethyl-5(3)-phenylpyrazole Related Literature
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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