Cas no 52456-96-9 (Benzenesulfonamide, N-[(4-nitrophenyl)thio]-)
![Benzenesulfonamide, N-[(4-nitrophenyl)thio]- structure](https://ossimg.kuujia.com/scimg/52500/52456-96-9x500.png)
52456-96-9 structure
Product Name:Benzenesulfonamide, N-[(4-nitrophenyl)thio]-
CAS No:52456-96-9
MF:C12H10N2O4S2
MW:310.348800182343
CID:359587
PubChem ID:12271454
Update Time:2025-04-19
Benzenesulfonamide, N-[(4-nitrophenyl)thio]- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide, N-[(4-nitrophenyl)thio]-
- N-(4-nitrophenyl)sulfanylbenzenesulfonamide
- DTXSID00483435
- 52456-96-9
-
- Inchi： 1S/C12H10N2O4S2/c15-14(16)10-6-8-11(9-7-10)19-13-20(17,18)12-4-2-1-3-5-12/h1-9,13H
- InChI Key： NOVFYZYGGMWYTJ-UHFFFAOYSA-N
- SMILES： S(C1C=CC=CC=1)(NSC1C=CC(=CC=1)[N+](=O)[O-])(=O)=O
Computed Properties
- Exact Mass: 310.0083
- Monoisotopic Mass: 310.00819915g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 416
- 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: 2.7
- Topological Polar Surface Area: 126?2
Experimental Properties
- PSA: 89.31
Benzenesulfonamide, N-[(4-nitrophenyl)thio]- Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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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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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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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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