Cas no 93894-71-4 (Isooctanesulfonamide,heptadecafluoro-N-methyl- (9CI))
93894-71-4 structure
Product Name:Isooctanesulfonamide,heptadecafluoro-N-methyl- (9CI)
CAS No:93894-71-4
MF:C9H4F17NO2S
MW:513.171421051025
CID:815623
PubChem ID:44147267
Update Time:2025-04-19
Isooctanesulfonamide,heptadecafluoro-N-methyl- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- Isooctanesulfonamide,heptadecafluoro-N-methyl- (9CI)
- 1,1,2,2,3,3,4,4,5,5,6,7,7,7-tetradecafluoro-N-methyl-6-(trifluoromethyl)heptane-1-sulfonamide
- heptadecafluoro-N-methylisooctanesulphonamide
- EINECS 299-771-6
- DTXSID10881125
- NS00011316
- HEPTADECAFLUORO-N-METHYLISOOCTANESULFONAMIDE
- 93894-71-4
-
- Inchi： 1S/C9H4F17NO2S/c1-27-30(28,29)9(25,26)6(17,18)5(15,16)4(13,14)3(11,12)2(10,7(19,20)21)8(22,23)24/h27H,1H3
- InChI Key： ZGKQZNCLVBOAST-UHFFFAOYSA-N
- SMILES： S(C(C(C(C(C(C(C(F)(F)F)(C(F)(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(NC)(=O)=O
Computed Properties
- Exact Mass: 512.969
- Monoisotopic Mass: 512.969
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 20
- Heavy Atom Count: 30
- Rotatable Bond Count: 7
- Complexity: 729
- 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: 5.2
- Topological Polar Surface Area: 54.6A^2
Isooctanesulfonamide,heptadecafluoro-N-methyl- (9CI) Related Literature
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Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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