Cas no 6395-45-5 (9H-Fluorene-1-carboxylicacid, 6-bromo-9-oxo-, methyl ester)
6395-45-5 structure
Product Name:9H-Fluorene-1-carboxylicacid, 6-bromo-9-oxo-, methyl ester
CAS No:6395-45-5
MF:C6H5ClF6O2
MW:258.546122312546
CID:504455
PubChem ID:5200954
Update Time:2025-04-19
9H-Fluorene-1-carboxylicacid, 6-bromo-9-oxo-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- 9H-Fluorene-1-carboxylicacid, 6-bromo-9-oxo-, methyl ester
- ethyl 4-chloro-2,2,3,3,4,4-hexafluorobutanoate
- AKOS003788930
- DTXSID60409510
- 6395-45-5
-
- Inchi： 1S/C6H5ClF6O2/c1-2-15-3(14)4(8,9)5(10,11)6(7,12)13/h2H2,1H3
- InChI Key： HBMRWVJHONGWMS-UHFFFAOYSA-N
- SMILES： ClC(C(C(C(=O)OCC)(F)F)(F)F)(F)F
Computed Properties
- Exact Mass: 257.98825
- Monoisotopic Mass: 257.988
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 254
- 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
- Topological Polar Surface Area: 26.3A^2
Experimental Properties
- Density: 1.475
- Boiling Point: 138.9°C at 760 mmHg
- Flash Point: 37°C
- Refractive Index: 1.346
- PSA: 26.3
9H-Fluorene-1-carboxylicacid, 6-bromo-9-oxo-, methyl ester Related Literature
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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