Cas no 57025-45-3 (Propanoic acid, 2,2-dimethyl-, 2,4-dinitrophenyl ester)
57025-45-3 structure
Product Name:Propanoic acid, 2,2-dimethyl-, 2,4-dinitrophenyl ester
CAS No:57025-45-3
MF:C11H12N2O6
MW:268.222783088684
CID:346882
PubChem ID:545373
Update Time:2025-04-19
Propanoic acid, 2,2-dimethyl-, 2,4-dinitrophenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2,2-dimethyl-, 2,4-dinitrophenyl ester
- (2,4-dinitrophenyl) 2,2-dimethylpropanoate
- DTXSID10337894
- SEBUYNOQPFWJRJ-UHFFFAOYSA-N
- 57025-45-3
- 2,4-Dinitrophenyl pivalate #
-
- Inchi： 1S/C11H12N2O6/c1-11(2,3)10(14)19-9-5-4-7(12(15)16)6-8(9)13(17)18/h4-6H,1-3H3
- InChI Key： SEBUYNOQPFWJRJ-UHFFFAOYSA-N
- SMILES： O(C1C=CC(=CC=1[N+](=O)[O-])[N+](=O)[O-])C(C(C)(C)C)=O
Computed Properties
- Exact Mass: 268.06956
- Monoisotopic Mass: 268.06953611g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 378
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.8
- Topological Polar Surface Area: 118?2
Experimental Properties
- PSA: 112.58
Propanoic acid, 2,2-dimethyl-, 2,4-dinitrophenyl ester Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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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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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
57025-45-3 (Propanoic acid, 2,2-dimethyl-, 2,4-dinitrophenyl ester) Related Products
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- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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