Cas no 181294-58-6 (2-Propenal, 3-[(1,1-dimethylethyl)amino]-2-nitro-)
![2-Propenal, 3-[(1,1-dimethylethyl)amino]-2-nitro- structure](https://ossimg.kuujia.com/scimg/181500/181294-58-6x500.png)
181294-58-6 structure
Product Name:2-Propenal, 3-[(1,1-dimethylethyl)amino]-2-nitro-
CAS No:181294-58-6
MF:C7H12N2O3
MW:172.181781768799
CID:1372711
Update Time:2024-08-14
2-Propenal, 3-[(1,1-dimethylethyl)amino]-2-nitro- Chemical and Physical Properties
Names and Identifiers
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- 2-Propenal, 3-[(1,1-dimethylethyl)amino]-2-nitro-
-
- Inchi： 1S/C7H12N2O3/c1-7(2,3)8-4-6(5-10)9(11)12/h4-5,8H,1-3H3
- InChI Key： DJIPEWIVRFHCOA-UHFFFAOYSA-N
- SMILES： C(=O)C([N+]([O-])=O)=CNC(C)(C)C
Computed Properties
- Exact Mass: 172.08486
Experimental Properties
- Density: 1.100±0.06 g/cm3(Predicted)
- Boiling Point: 360.2±32.0 °C(Predicted)
- PSA: 72.24
- pka: 0.76±0.70(Predicted)
2-Propenal, 3-[(1,1-dimethylethyl)amino]-2-nitro- Related Literature
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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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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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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