Cas no 143287-98-3 (Methanesulfonic acid, trifluoro-, 3,4,5-trimethoxyphenyl ester)
143287-98-3 structure
Product Name:Methanesulfonic acid, trifluoro-, 3,4,5-trimethoxyphenyl ester
CAS No:143287-98-3
MF:C10H11F3O6S
MW:316.250952959061
CID:1312940
PubChem ID:10892447
Update Time:2025-04-20
Methanesulfonic acid, trifluoro-, 3,4,5-trimethoxyphenyl ester Chemical and Physical Properties
Names and Identifiers
-
- Methanesulfonic acid, trifluoro-, 3,4,5-trimethoxyphenyl ester
- (3,4,5-trimethoxyphenyl) trifluoromethanesulfonate
- JXEGJWUFDKLTSM-UHFFFAOYSA-N
- 143287-98-3
- SCHEMBL8502930
- DTXSID50447441
-
- Inchi： 1S/C10H11F3O6S/c1-16-7-4-6(5-8(17-2)9(7)18-3)19-20(14,15)10(11,12)13/h4-5H,1-3H3
- InChI Key： JXEGJWUFDKLTSM-UHFFFAOYSA-N
- SMILES： S(C(F)(F)F)(=O)(=O)OC1C=C(C(=C(C=1)OC)OC)OC
Computed Properties
- Exact Mass: 316.02283
- Monoisotopic Mass: 316.02284373g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 9
- Heavy Atom Count: 20
- Rotatable Bond Count: 5
- Complexity: 390
- 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: 2.6
- Topological Polar Surface Area: 79.4?2
Experimental Properties
- PSA: 71.06
Methanesulfonic acid, trifluoro-, 3,4,5-trimethoxyphenyl ester Related Literature
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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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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