Cas no 67547-14-2 ( )
structure
Product Name:
CAS No:67547-14-2
MF:C10H12F3NO
MW:219.203593254089
CID:874333
PubChem ID:45081192
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 1-(1,3,3a,4,5,7a-hexahydroisoindol-2-yl)-2,2,2-trifluoroethanone
- 1H-Isoindole, 2,3,3a,4,5,7a-hexahydro-2-(trifluoroacetyl)- (9CI)
- Ethanone, 2,2,2-trifluoro-1-(1,3,3a,4,5,7a-hexahydro-2H-isoindol-2-yl)-
- 67547-14-2
- DTXSID60664425
- 1H-Isoindole,2,3,3a,4,5,7a-hexahydro-2-(trifluoroacetyl)-(9ci)
- 2,2,2-Trifluoro-1-(1,3,3a,4,5,7a-hexahydro-2H-isoindol-2-yl)ethan-1-one
-
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- Inchi： 1S/C10H12F3NO/c11-10(12,13)9(15)14-5-7-3-1-2-4-8(7)6-14/h1,3,7-8H,2,4-6H2
- InChI Key： TWRGGEBFZHEKMV-UHFFFAOYSA-N
- SMILES： FC(C(N1CC2C=CCCC2C1)=O)(F)F
Computed Properties
- Exact Mass: 219.087
- Monoisotopic Mass: 219.087
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 298
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 20.3A^2
- XLogP3: 2.2
Related Literature
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
-
Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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4. Fe3O4/Au/Fe3O4 nanoflowers exhibiting tunable saturation magnetization and enhanced bioconjugationFeng Shi,Kunping Yan,Mingli Peng,Xiao Cheng,Yanling Luo,Xuemei Chen,V. A. L. Roy,Zuankai Wang Nanoscale, 2012,4, 747-751
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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