Cas no 100453-64-3 (Cyclohexanebutanoic acid, 1-nitro-, ethyl ester)
100453-64-3 structure
Product Name:Cyclohexanebutanoic acid, 1-nitro-, ethyl ester
CAS No:100453-64-3
MF:C12H21NO4
MW:243.29944396019
CID:1127950
Update Time:2024-07-27
Cyclohexanebutanoic acid, 1-nitro-, ethyl ester Chemical and Physical Properties
Names and Identifiers
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- Cyclohexanebutanoic acid, 1-nitro-, ethyl ester
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- Inchi： 1S/C12H21NO4/c1-2-17-11(14)7-6-10-12(13(15)16)8-4-3-5-9-12/h2-10H2,1H3
- InChI Key： XGZRVORDHJTTMU-UHFFFAOYSA-N
- SMILES： C1([N+]([O-])=O)(CCCC(OCC)=O)CCCCC1
Computed Properties
- Exact Mass: 243.14713
Experimental Properties
- Density: 1.08±0.1 g/cm3(Predicted)
- Boiling Point: 331.1±11.0 °C(Predicted)
- PSA: 69.44
Cyclohexanebutanoic acid, 1-nitro-, ethyl ester Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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