Cas no 20819-71-0 (1-fluoro-4-nitro-2-(trifluoromethylsulfonyl)benzene)
20819-71-0 structure
Product Name:1-fluoro-4-nitro-2-(trifluoromethylsulfonyl)benzene
CAS No:20819-71-0
MF:C7H3F4NO4S
MW:273.161634683609
CID:1396221
PubChem ID:68072709
Update Time:2025-04-20
1-fluoro-4-nitro-2-(trifluoromethylsulfonyl)benzene Chemical and Physical Properties
Names and Identifiers
-
- 1-fluoro-4-nitro-2-(trifluoromethylsulfonyl)benzene
- 1-fluoro-4-nitro-2-[(trifluoromethyl)sulfonyl]Benzene
- 20819-71-0
- SCHEMBL10235627
- RTCZWNVFWCERKZ-UHFFFAOYSA-N
- DA-19205
-
- Inchi： 1S/C7H3F4NO4S/c8-5-2-1-4(12(13)14)3-6(5)17(15,16)7(9,10)11/h1-3H
- InChI Key： RTCZWNVFWCERKZ-UHFFFAOYSA-N
- SMILES： S(C(F)(F)F)(C1C(=CC=C(C=1)[N+](=O)[O-])F)(=O)=O
Computed Properties
- Exact Mass: 272.97189140g/mol
- Monoisotopic Mass: 272.97189140g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 17
- Rotatable Bond Count: 1
- Complexity: 396
- 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: 2.3
- Topological Polar Surface Area: 88.3?2
1-fluoro-4-nitro-2-(trifluoromethylsulfonyl)benzene Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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