Cas no 118469-17-3 (1H-Benzimidazole,5-fluoro-1-(fluoromethyl)-2-methyl-)
118469-17-3 structure
Product Name:1H-Benzimidazole,5-fluoro-1-(fluoromethyl)-2-methyl-
CAS No:118469-17-3
MF:C9H8F2N2
MW:182.170028686523
CID:132951
PubChem ID:45078132
Update Time:2025-04-19
1H-Benzimidazole,5-fluoro-1-(fluoromethyl)-2-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole,5-fluoro-1-(fluoromethyl)-2-methyl-
- 1H-Benzimidazole,5-fluoro-1-(fluoromethyl)-2-methyl-(9CI)
- 5-Fluoro-1-(fluoromethyl)-2-methyl-1H-benzo[d]imidazole
- 118469-17-3
-
- Inchi： 1S/C9H8F2N2/c1-6-12-8-4-7(11)2-3-9(8)13(6)5-10/h2-4H,5H2,1H3
- InChI Key： IIWXVNVBHGPUPO-UHFFFAOYSA-N
- SMILES： FCN1C(C)=NC2C=C(C=CC1=2)F
Computed Properties
- Exact Mass: 182.066
- Monoisotopic Mass: 182.066
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 189
- 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
- Topological Polar Surface Area: 17.8A^2
- XLogP3: 2.3
1H-Benzimidazole,5-fluoro-1-(fluoromethyl)-2-methyl- Related Literature
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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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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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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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