Cas no 782501-70-6 (1-[2-[(2-Aminoethyl)amino]ethyl]-1H-pyrazole)
![1-[2-[(2-Aminoethyl)amino]ethyl]-1H-pyrazole structure](https://ossimg.kuujia.com/scimg/783000/782501-70-6x500.png)
782501-70-6 structure
Product Name:1-[2-[(2-Aminoethyl)amino]ethyl]-1H-pyrazole
CAS No:782501-70-6
MF:C7H14N4
MW:154.212860584259
CID:554041
Update Time:2023-08-02
1-[2-[(2-Aminoethyl)amino]ethyl]-1H-pyrazole Chemical and Physical Properties
Names and Identifiers
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- 1,2-Ethanediamine,N1-[2-(1H-pyrazol-1-yl)ethyl]-
- 1,2-Ethanediamine,N-[2-(1H-pyrazol-1-yl)ethyl]- (9CI)
- N-(1-pyrazolyl)ethyl-ethane-1,2-diamine
- 1-[2-[(2-Aminoethyl)amino]ethyl]-1H-pyrazole
- N1-(2-(1H-Pyrazol-1-yl)ethyl)ethane-1,2-diamine
-
- Inchi： 1S/C7H14N4/c8-2-4-9-5-7-11-6-1-3-10-11/h1,3,6,9H,2,4-5,7-8H2
- InChI Key： NPZAACUQZSHWCH-UHFFFAOYSA-N
- SMILES： N(CCN)CCN1C=CC=N1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 96.4
- Topological Polar Surface Area: 55.9
1-[2-[(2-Aminoethyl)amino]ethyl]-1H-pyrazole Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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