Cas no 918812-08-5 (Benzonitrile, 2-(ethylsulfonyl)-)
918812-08-5 structure
Product Name:Benzonitrile, 2-(ethylsulfonyl)-
CAS No:918812-08-5
MF:C9H9NO2S
MW:195.238260984421
CID:770645
PubChem ID:58789085
Update Time:2025-04-19
Benzonitrile, 2-(ethylsulfonyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzonitrile, 2-(ethylsulfonyl)-
- 2-ethylsulfonylbenzonitrile
- 2-(Ethanesulfonyl)benzonitrile
- DTXSID00730072
- 918812-08-5
- SCHEMBL4599700
- YRGWLORKNGBAAH-UHFFFAOYSA-N
- 2-(Ethylsulfonyl)benzonitrile
-
- Inchi： 1S/C9H9NO2S/c1-2-13(11,12)9-6-4-3-5-8(9)7-10/h3-6H,2H2,1H3
- InChI Key： YRGWLORKNGBAAH-UHFFFAOYSA-N
- SMILES： S(C1C=CC=CC=1C#N)(CC)(=O)=O
Computed Properties
- Exact Mass: 195.03539970g/mol
- Monoisotopic Mass: 195.03539970g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 306
- 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: 1.2
- Topological Polar Surface Area: 66.3?2
Benzonitrile, 2-(ethylsulfonyl)- Related Literature
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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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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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Christian K. Rank,Alexander W. Jones,Tatjana Wall,Patrick Di Martino-Fumo,Sarah Schr?ck,Markus Gerhards,Frederic W. Patureau Chem. Commun., 2019,55, 13749-13752
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5. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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