Cas no 14357-51-8 (Carbamic acid, (4-nitrophenyl)-, 1-methylethyl ester)
14357-51-8 structure
Product Name:Carbamic acid, (4-nitrophenyl)-, 1-methylethyl ester
CAS No:14357-51-8
MF:C10H12N2O4
MW:224.213282585144
CID:1313558
PubChem ID:12931994
Update Time:2025-04-20
Carbamic acid, (4-nitrophenyl)-, 1-methylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbamic acid, (4-nitrophenyl)-, 1-methylethyl ester
- propan-2-yl N-(4-nitrophenyl)carbamate
- 14357-51-8
- SCHEMBL9994168
- DTXSID80513289
- Propan-2-yl (4-nitrophenyl)carbamate
-
- Inchi： 1S/C10H12N2O4/c1-7(2)16-10(13)11-8-3-5-9(6-4-8)12(14)15/h3-7H,1-2H3,(H,11,13)
- InChI Key： NOQDDMGTSULNAG-UHFFFAOYSA-N
- SMILES： O(C(NC1C=CC(=CC=1)[N+](=O)[O-])=O)C(C)C
Computed Properties
- Exact Mass: 224.07976
- Monoisotopic Mass: 224.07970687g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 254
- 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: 2.4
- Topological Polar Surface Area: 84.2?2
Experimental Properties
- PSA: 81.47
Carbamic acid, (4-nitrophenyl)-, 1-methylethyl ester Related Literature
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Mei-Yu Xu,Ya-Ting Wang,Qing-Ling Ni,Zi-Hao Zhang,Guang-Ming Liang,Liu-Cheng Gui Dalton Trans., 2016,45, 4993-4997
14357-51-8 (Carbamic acid, (4-nitrophenyl)-, 1-methylethyl ester) Related Products
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- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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