Cas no 746630-13-7 (Benzenesulfonamide, 4-isothiocyanato-2-(trifluoromethyl)-)
746630-13-7 structure
Product Name:Benzenesulfonamide, 4-isothiocyanato-2-(trifluoromethyl)-
CAS No:746630-13-7
MF:C8H5F3N2O2S2
MW:282.262709379196
CID:1768879
Update Time:2024-11-27
Benzenesulfonamide, 4-isothiocyanato-2-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
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- Benzenesulfonamide, 4-isothiocyanato-2-(trifluoromethyl)-
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- Inchi： 1S/C8H5F3N2O2S2/c9-8(10,11)6-3-5(13-4-16)1-2-7(6)17(12,14)15/h1-3H,(H2,12,14,15)
- InChI Key： COOKDWPLVUXKKJ-UHFFFAOYSA-N
- SMILES： C1(S(N)(=O)=O)=CC=C(N=C=S)C=C1C(F)(F)F
Computed Properties
- Exact Mass: 281.97455
Experimental Properties
- Density: 1.59±0.1 g/cm3(Predicted)
- Boiling Point: 421.4±55.0 °C(Predicted)
- PSA: 72.52
- pka: 9.26±0.60(Predicted)
Benzenesulfonamide, 4-isothiocyanato-2-(trifluoromethyl)- Related Literature
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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