Cas no 59106-05-7 (5-(Bicyclo[2.2.2]octan-2-yl)-1H-imidazole)
59106-05-7 structure
Product Name:5-(Bicyclo[2.2.2]octan-2-yl)-1H-imidazole
CAS No:59106-05-7
MF:C11H16N2
MW:176.258142471313
CID:2833966
PubChem ID:12369713
Update Time:2025-04-21
5-(Bicyclo[2.2.2]octan-2-yl)-1H-imidazole Chemical and Physical Properties
Names and Identifiers
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- 59106-05-7
- DTXSID70494755
- 5-(Bicyclo[2.2.2]octan-2-yl)-1H-imidazole
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- Inchi: 1S/C11H16N2/c1-3-9-4-2-8(1)5-10(9)11-6-12-7-13-11/h6-10H,1-5H2,(H,12,13)
- InChI Key: DMGQFDXQHBHLMF-UHFFFAOYSA-N
- SMILES: N1C=NC=C1C1CC2CCC1CC2
Computed Properties
- Exact Mass: 176.131348519Da
- Monoisotopic Mass: 176.131348519Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 185
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.7
- Topological Polar Surface Area: 28.7?2
5-(Bicyclo[2.2.2]octan-2-yl)-1H-imidazole Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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