Cas no 312-58-3 (Benzenesulfonamide, 4-fluoro-N-(4-fluorophenyl)-)
312-58-3 structure
Product Name:Benzenesulfonamide, 4-fluoro-N-(4-fluorophenyl)-
CAS No:312-58-3
MF:C12H9F2NO2S
MW:269.2671687603
CID:1452297
PubChem ID:573540
Update Time:2025-04-20
Benzenesulfonamide, 4-fluoro-N-(4-fluorophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide, 4-fluoro-N-(4-fluorophenyl)-
- CHEMBL183231
- AE-848/06093047
- STK021708
- 4-fluoro-N-(4-fluorophenyl)benzene-1-sulfonamide
- AKOS003235870
- 312-58-3
- 4-Fluoro-N-(4-fluorophenyl)benzenesulfonamide #
- 4-Fluoro-N-(4-fluoro-phenyl)-benzenesulfonamide
- Cambridge id 5348944
- 4-Fluoro-N-(4-fluorophenyl)benzenesulfonamide
- DTXSID101251413
- SCHEMBL7501950
- AB00082056-01
- SR-01000206204-1
- SR-01000206204
-
- Inchi： 1S/C12H9F2NO2S/c13-9-1-5-11(6-2-9)15-18(16,17)12-7-3-10(14)4-8-12/h1-8,15H
- InChI Key： VZBCYMGTJFEUCK-UHFFFAOYSA-N
- SMILES： S(C1C=CC(=CC=1)F)(NC1C=CC(=CC=1)F)(=O)=O
Computed Properties
- Exact Mass: 269.03227
- Monoisotopic Mass: 269.03220603g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 353
- 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: 3
- Topological Polar Surface Area: 54.6?2
Experimental Properties
- PSA: 46.17
Benzenesulfonamide, 4-fluoro-N-(4-fluorophenyl)- Related Literature
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Felix Witte,Philipp Rietsch,Nithiya Nirmalananthan-Budau,Florian Weigert,Jan P. G?tze,Ute Resch-Genger,Siegfried Eigler,Beate Paulus Phys. Chem. Chem. Phys., 2021,23, 17521-17529
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
312-58-3 (Benzenesulfonamide, 4-fluoro-N-(4-fluorophenyl)-) Related Products
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