Cas no 67122-24-1 (9,10-Anthracenedione, 1,4-dimethoxy-2,3-dimethyl-)
67122-24-1 structure
Product Name:9,10-Anthracenedione, 1,4-dimethoxy-2,3-dimethyl-
CAS No:67122-24-1
MF:C18H16O4
MW:296.317245483398
CID:395330
PubChem ID:13944287
Update Time:2025-04-19
9,10-Anthracenedione, 1,4-dimethoxy-2,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-dimethoxy-2,3-dimethylanthracene-9,10-dione
- 9,10-Anthracenedione, 1,4-dimethoxy-2,3-dimethyl-
- 1,4-dimethoxy-2,3-dimethyl-9,10-anthraquinone
- 67122-24-1
- DTXSID10552989
-
- Inchi： 1S/C18H16O4/c1-9-10(2)18(22-4)14-13(17(9)21-3)15(19)11-7-5-6-8-12(11)16(14)20/h5-8H,1-4H3
- InChI Key： ZJDKRUIQBPNHPD-UHFFFAOYSA-N
- SMILES： O(C)C1C(C)=C(C)C(=C2C(C3C=CC=CC=3C(C2=1)=O)=O)OC
Computed Properties
- Exact Mass: 296.10488
- Monoisotopic Mass: 296.10485899g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 418
- 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: 3.5
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
9,10-Anthracenedione, 1,4-dimethoxy-2,3-dimethyl- Related Literature
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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