Cas no 40958-82-5 (1H-Pyrazole, sodiumsalt (1:1))
1H-Pyrazole, sodiumsalt (1:1) structure
Product Name:1H-Pyrazole, sodiumsalt (1:1)
CAS No:40958-82-5
MF:C3H3N2Na
MW:90.0590908527374
CID:332158
PubChem ID:12107527
Update Time:2025-04-19
1H-Pyrazole, sodiumsalt (1:1) Chemical and Physical Properties
Names and Identifiers
-
- 1H-pyrazole, sodium salt
- 1H-Pyrazole, sodiumsalt (1:1)
- sodium,pyrazol-2-ide
- 1H-PYRAZOLE,SODIUM SALT
- 40958-82-5
- sodium pyrazolide
- UBXSXHIFPINFKS-UHFFFAOYSA-N
- NS00088809
- EINECS 255-164-8
- DTXSID60193962
-
- Inchi： 1S/C3H3N2.Na/c1-2-4-5-3-1;/h1-3H;/q-1;+1
- InChI Key： UBXSXHIFPINFKS-UHFFFAOYSA-N
- SMILES： [Na+].[N-]1C=CC=N1
Computed Properties
- Exact Mass: 90.019393
- Monoisotopic Mass: 90.019393
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 6
- Rotatable Bond Count: 0
- Complexity: 32
- 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: 13.9
Experimental Properties
- Boiling Point: 187°Cat760mmHg
- Flash Point: 87.5°C
1H-Pyrazole, sodiumsalt (1:1) Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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