Cas no 1195774-88-9 (2-ethyl-6-fluoro-1H-Benzimidazole)
1195774-88-9 structure
Product Name:2-ethyl-6-fluoro-1H-Benzimidazole
CAS No:1195774-88-9
MF:C9H9FN2
MW:164.179565191269
CID:1101321
PubChem ID:22439097
Update Time:2025-04-20
2-ethyl-6-fluoro-1H-Benzimidazole Chemical and Physical Properties
Names and Identifiers
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- 2-ethyl-6-fluoro-1H-Benzimidazole
- DB-061572
- A18121
- 2-ethyl-6-fluoro-1H-benzo[d]imidazole
- SCHEMBL8417202
- 1H-Benzimidazole, 2-ethyl-6-fluoro-
- 1195774-88-9
- AKOS010204730
-
- Inchi： 1S/C9H9FN2/c1-2-9-11-7-4-3-6(10)5-8(7)12-9/h3-5H,2H2,1H3,(H,11,12)
- InChI Key： CIVXQEHQUVADKX-UHFFFAOYSA-N
- SMILES： FC1C=CC2=C(C=1)NC(CC)=N2
Computed Properties
- Exact Mass: 164.07497646g/mol
- Monoisotopic Mass: 164.07497646g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 163
- 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: 2.9
- Topological Polar Surface Area: 28.7?2
2-ethyl-6-fluoro-1H-Benzimidazole Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Yuan-Jun Tong,Lu-Dan Yu,Lu-Lu Wu,Shu-Ping Cao,Ru-Ping Liang,Li Zhang,Xing-Hua Xia,Jian-Ding Qiu Chem. Commun., 2018,54, 7487-7490
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Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
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