Cas no 50418-77-4 (Sulfoximine, S-methyl-S-(2,4,6-trimethylphenyl)-)
50418-77-4 structure
Product Name:Sulfoximine, S-methyl-S-(2,4,6-trimethylphenyl)-
CAS No:50418-77-4
MF:C10H15NOS
MW:197.297201395035
CID:4009359
PubChem ID:12173608
Update Time:2025-04-22
Sulfoximine, S-methyl-S-(2,4,6-trimethylphenyl)- Chemical and Physical Properties
Names and Identifiers
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- Sulfoximine, S-methyl-S-(2,4,6-trimethylphenyl)-
- 50418-77-4
- DTXSID701237548
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- Inchi： 1S/C10H15NOS/c1-7-5-8(2)10(9(3)6-7)13(4,11)12/h5-6,11H,1-4H3
- InChI Key： NXGOERDLUITLLA-UHFFFAOYSA-N
- SMILES： S(C)(C1C(C)=CC(C)=CC=1C)(=N)=O
Computed Properties
- Exact Mass: 197.08743528Da
- Monoisotopic Mass: 197.08743528Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 269
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.5
- Topological Polar Surface Area: 49.3?2
Sulfoximine, S-methyl-S-(2,4,6-trimethylphenyl)- Related Literature
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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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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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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