Cas no 120801-76-5 (Acetic acid, difluoro(fluorosulfonyl)-, 2-bromoethyl ester)
120801-76-5 structure
Product Name:Acetic acid, difluoro(fluorosulfonyl)-, 2-bromoethyl ester
CAS No:120801-76-5
MF:C4H4BrF3O4S
MW:285.036370277405
CID:3685557
PubChem ID:14269690
Update Time:2025-04-22
Acetic acid, difluoro(fluorosulfonyl)-, 2-bromoethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, difluoro(fluorosulfonyl)-, 2-bromoethyl ester
- DTXSID701224898
- 120801-76-5
- 2-Bromoethyl 2,2-difluoro-2-(fluorosulfonyl)acetate
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- Inchi： 1S/C4H4BrF3O4S/c5-1-2-12-3(9)4(6,7)13(8,10)11/h1-2H2
- InChI Key： VDNSOAZQQRBSJY-UHFFFAOYSA-N
- SMILES： BrCCOC(C(F)(F)S(=O)(=O)F)=O
Computed Properties
- Exact Mass: 283.89658Da
- Monoisotopic Mass: 283.89658Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 13
- Rotatable Bond Count: 5
- Complexity: 282
- 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: 1.6
- Topological Polar Surface Area: 68.8?2
Acetic acid, difluoro(fluorosulfonyl)-, 2-bromoethyl ester Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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