Cas no 89983-95-9 (Benzenesulfonyl isocyanate, 3-(trifluoromethyl)-)
89983-95-9 structure
Product Name:Benzenesulfonyl isocyanate, 3-(trifluoromethyl)-
CAS No:89983-95-9
MF:C8H4F3NO3S
MW:251.18247127533
CID:584152
PubChem ID:15232648
Update Time:2025-04-19
Benzenesulfonyl isocyanate, 3-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonyl isocyanate, 3-(trifluoromethyl)-
- N-(oxomethylidene)-3-(trifluoromethyl)benzenesulfonamide
- DTXSID70570326
- 89983-95-9
- 3-(Trifluoromethyl)benzene-1-sulfonyl isocyanate
- SCHEMBL9871617
- CFLBHLOMDJUFLL-UHFFFAOYSA-N
-
- Inchi： 1S/C8H4F3NO3S/c9-8(10,11)6-2-1-3-7(4-6)16(14,15)12-5-13/h1-4H
- InChI Key： CFLBHLOMDJUFLL-UHFFFAOYSA-N
- SMILES： S(C1C=CC=C(C(F)(F)F)C=1)(N=C=O)(=O)=O
Computed Properties
- Exact Mass: 250.98639865g/mol
- Monoisotopic Mass: 250.98639865g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 392
- 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: 3.2
- Topological Polar Surface Area: 72?2
Benzenesulfonyl isocyanate, 3-(trifluoromethyl)- Related Literature
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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2. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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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
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