Cas no 21581-82-8 (1-Butene,1,1,2,3,4,4,4-heptafluoro-3-(trifluoromethyl)-)
21581-82-8 structure
Product Name:1-Butene,1,1,2,3,4,4,4-heptafluoro-3-(trifluoromethyl)-
1-Butene,1,1,2,3,4,4,4-heptafluoro-3-(trifluoromethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1-Butene,1,1,2,3,4,4,4-heptafluoro-3-(trifluoromethyl)-
- 1,1,2,3,4,4,4-Heptafluoro-3-(trifluoromethyl)but-1-ene
- perfluoroisopropylethylene
- SCHEMBL2065366
- CPAQQPJFMVGXBQ-UHFFFAOYSA-N
- 21581-82-8
- DTXSID60175945
- NS00018849
- EINECS 244-455-5
-
- Inchi： 1S/C5F10/c6-1(2(7)8)3(9,4(10,11)12)5(13,14)15
- InChI Key： CPAQQPJFMVGXBQ-UHFFFAOYSA-N
- SMILES： FC(/C(=C(\F)/F)/F)(C(F)(F)F)C(F)(F)F
Computed Properties
- Exact Mass: 249.984
- Monoisotopic Mass: 249.984
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 249
- 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: 3.3
- Topological Polar Surface Area: 0?2
Experimental Properties
- Density: 1.573
- Boiling Point: 27.6°Cat760mmHg
- Flash Point: °C
- Refractive Index: 1.264
- PSA: 0
1-Butene,1,1,2,3,4,4,4-heptafluoro-3-(trifluoromethyl)- Related Literature
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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