Cas no 113969-40-7 (9-phenylanthracene-1,4-dione)
9-phenylanthracene-1,4-dione structure
Product Name:9-phenylanthracene-1,4-dione
CAS No:113969-40-7
MF:C20H12O2
MW:284.308085441589
CID:2612040
PubChem ID:13688452
Update Time:2025-04-21
9-phenylanthracene-1,4-dione Chemical and Physical Properties
Names and Identifiers
-
- 9-phenylanthracene-1,4-dione
- 113969-40-7
- DTXSID50546781
-
- Inchi： 1S/C20H12O2/c21-17-10-11-18(22)20-16(17)12-14-8-4-5-9-15(14)19(20)13-6-2-1-3-7-13/h1-12H
- InChI Key： HSQYSNFZBOZLNI-UHFFFAOYSA-N
- SMILES： O=C1C=CC(C2=CC3C=CC=CC=3C(C3C=CC=CC=3)=C21)=O
Computed Properties
- Exact Mass: 284.083729621Da
- Monoisotopic Mass: 284.083729621Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 22
- Rotatable Bond Count: 1
- Complexity: 486
- 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: 4.3
- Topological Polar Surface Area: 34.1?2
9-phenylanthracene-1,4-dione Related Literature
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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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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