Cas no 51303-72-1 (Benzene, [(2-fluoroethyl)sulfonyl]-)
51303-72-1 structure
Product Name:Benzene, [(2-fluoroethyl)sulfonyl]-
CAS No:51303-72-1
MF:C8H9FO2S
MW:188.219264745712
CID:362592
PubChem ID:66796542
Update Time:2025-04-19
Benzene, [(2-fluoroethyl)sulfonyl]- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, [(2-fluoroethyl)sulfonyl]-
- 2-fluoroethylsulfonylbenzene
- DTXSID70735791
- (2-Fluoroethanesulfonyl)benzene
- SCHEMBL778246
- 51303-72-1
-
- Inchi: 1S/C8H9FO2S/c9-6-7-12(10,11)8-4-2-1-3-5-8/h1-5H,6-7H2
- InChI Key: KSSCPGBAPDVQEE-UHFFFAOYSA-N
- SMILES: S(C1C=CC=CC=1)(CCF)(=O)=O
Computed Properties
- Exact Mass: 188.03077
- Monoisotopic Mass: 188.03072886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 212
- 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: 1.5
- Topological Polar Surface Area: 42.5?2
Experimental Properties
- PSA: 34.14
Benzene, [(2-fluoroethyl)sulfonyl]- Related Literature
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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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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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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