Cas no 914-20-5 ([1,1'-Bianthracene]-9,9',10,10'-tetrone)
914-20-5 structure
Product Name:[1,1'-Bianthracene]-9,9',10,10'-tetrone
[1,1'-Bianthracene]-9,9',10,10'-tetrone Chemical and Physical Properties
Names and Identifiers
-
- [1,1'-Bianthracene]-9,9',10,10'-tetrone
- 1-(9,10-dioxoanthracen-1-yl)anthracene-9,10-dione
- 1,1'-Bi[anthraquinone]
- [1,1']Bianthryl-9,10,9',10'-tetraon
- [1,1']bianthryl-9,10,9',10'-tetraone
- 1,1'-bi-anthrachinonyl
- 1,1'-bis(9,10-anthraquinone)
- Di-(anthrachinon-(9.10)-yl-(1))
- Dianthryl-(1.1')-dichinon-(9.10,9'.10')
- HMS588N11
- SCHEMBL5010110
- ChemDiv1_000649
- 914-20-5
- [1,1'-Bianthracene]-9,9',10,10'-tetraone
- bianthraquinone
- DTXSID70425160
-
- Inchi: 1S/C28H14O4/c29-25-17-7-1-3-9-19(17)27(31)23-15(11-5-13-21(23)25)16-12-6-14-22-24(16)28(32)20-10-4-2-8-18(20)26(22)30/h1-14H
- InChI Key: SZKSKYDUWNZBPR-UHFFFAOYSA-N
- SMILES: O=C1C2C=CC=CC=2C(C2C=CC=C(C=21)C1=CC=CC2C(C3C=CC=CC=3C(C1=2)=O)=O)=O
Computed Properties
- Exact Mass: 414.08900
- Monoisotopic Mass: 414.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 32
- Rotatable Bond Count: 1
- Complexity: 761
- 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: 5.4
- Topological Polar Surface Area: 68.3?2
Experimental Properties
- PSA: 68.28000
- LogP: 4.90440
[1,1'-Bianthracene]-9,9',10,10'-tetrone Related Literature
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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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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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
914-20-5 ([1,1'-Bianthracene]-9,9',10,10'-tetrone) Related Products
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