Cas no 26429-26-5 (1H-Pyrazolium,1,2-dimethyl-, iodide (1:1))
26429-26-5 structure
Product Name:1H-Pyrazolium,1,2-dimethyl-, iodide (1:1)
CAS No:26429-26-5
MF:C5H9IN2
MW:224.042833089828
CID:263769
PubChem ID:13001652
Update Time:2025-04-19
1H-Pyrazolium,1,2-dimethyl-, iodide (1:1) Chemical and Physical Properties
Names and Identifiers
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- 1H-Pyrazolium,1,2-dimethyl-, iodide (1:1)
- 1,2-dimethylpyrazol-1-ium,iodide
- 1,2-Dimethyl-1H-pyrazol-2-ium iodide
- DTXSID50514768
- 26429-26-5
- NSC-111903
- NSC111903
-
- Inchi： 1S/C5H9N2.HI/c1-6-4-3-5-7(6)2;/h3-5H,1-2H3;1H/q+1;/p-1
- InChI Key： ZTLDHYRNCKKRMH-UHFFFAOYSA-M
- SMILES： [I-].[N+]1(C)=CC=CN1C
Computed Properties
- Exact Mass: 97.07667
- Monoisotopic Mass: 223.981041
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 8
- Rotatable Bond Count: 0
- Complexity: 55.1
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 8.8
Experimental Properties
- Boiling Point: °Cat760mmHg
- Flash Point: °C
- PSA: 8.81
1H-Pyrazolium,1,2-dimethyl-, iodide (1:1) Related Literature
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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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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Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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