Cas no 52835-17-3 (Oxirane, (tridecafluorohexyl)-)
52835-17-3 structure
Product Name:Oxirane, (tridecafluorohexyl)-
CAS No:52835-17-3
MF:C8H3F13O
MW:362.088068246841
CID:358667
PubChem ID:13198229
Update Time:2025-04-19
Oxirane, (tridecafluorohexyl)- Chemical and Physical Properties
Names and Identifiers
-
- Oxirane, (tridecafluorohexyl)-
- 2-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)oxirane
- 52835-17-3
- 2-(Tridecafluorohexyl)oxirane
- DTXSID60526670
- SCHEMBL5945084
- XLLHDUOEQXDROH-UHFFFAOYSA-N
-
- Inchi： 1S/C8H3F13O/c9-3(10,2-1-22-2)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h2H,1H2
- InChI Key： XLLHDUOEQXDROH-UHFFFAOYSA-N
- SMILES： FC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C1CO1)F
Computed Properties
- Exact Mass: 361.99759
- Monoisotopic Mass: 361.9976308g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 14
- Heavy Atom Count: 22
- Rotatable Bond Count: 5
- Complexity: 436
- 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: 4.4
- Topological Polar Surface Area: 12.5?2
Experimental Properties
- PSA: 12.53
Oxirane, (tridecafluorohexyl)- Related Literature
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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