Cas no 652171-14-7 (Benzene, 1,3-difluoro-2-(methylsulfonyl)-)
652171-14-7 structure
Product Name:Benzene, 1,3-difluoro-2-(methylsulfonyl)-
CAS No:652171-14-7
MF:C7H6F2O2S
MW:192.183147907257
CID:401831
PubChem ID:20782032
Update Time:2025-04-19
Benzene, 1,3-difluoro-2-(methylsulfonyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,3-difluoro-2-(methylsulfonyl)-
- 1,3-difluoro-2-methylsulfonylbenzene
- 652171-14-7
- 1,3-Difluoro-2-(methanesulfonyl)benzene
- DTXSID60609770
- SCHEMBL4139118
- 2,6-difluorophenyl methyl sulfone
-
- Inchi： 1S/C7H6F2O2S/c1-12(10,11)7-5(8)3-2-4-6(7)9/h2-4H,1H3
- InChI Key： JAMWUKHJLKFDAU-UHFFFAOYSA-N
- SMILES： S(C)(C1C(=CC=CC=1F)F)(=O)=O
Computed Properties
- Exact Mass: 192.00568
- Monoisotopic Mass: 192.00565693g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 235
- 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: 1.4
- Topological Polar Surface Area: 42.5?2
Experimental Properties
- PSA: 34.14
Benzene, 1,3-difluoro-2-(methylsulfonyl)- Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
652171-14-7 (Benzene, 1,3-difluoro-2-(methylsulfonyl)-) Related Products
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- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
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- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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