Cas no 3736-59-2 (2-Anthracenecarboxaldehyde,9,10-dihydro-1,3-dihydroxy-9,10-dioxo-)
3736-59-2 structure
Product Name:2-Anthracenecarboxaldehyde,9,10-dihydro-1,3-dihydroxy-9,10-dioxo-
2-Anthracenecarboxaldehyde,9,10-dihydro-1,3-dihydroxy-9,10-dioxo- Chemical and Physical Properties
Names and Identifiers
-
- 2-Anthracenecarboxaldehyde,9,10-dihydro-1,3-dihydroxy-9,10-dioxo-
- 1,3-dihydroxy-9,10-dioxoanthracene-2-carbaldehyde
- CCRIS 6442
- 1,3-DIHYDROXY-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBALDEHYDE
- 2-Anthracenecarboxaldehyde, 9,10-dihydro-1,3-dihydroxy-9,10-dioxo-
- 1,3-dihydroxy-9,10-dioxo-anthracene-2-carbaldehyde
- SCHEMBL16227182
- 3736-59-2
- Nordamnacanthal
- CHEMBL2297225
- DTXSID10190805
-
- Inchi： 1S/C15H8O5/c16-6-10-11(17)5-9-12(15(10)20)14(19)8-4-2-1-3-7(8)13(9)18/h1-6,17,20H
- InChI Key： NSGZEHPFOUCUHD-UHFFFAOYSA-N
- SMILES： OC1=C(C=O)C(=CC2C(C3C=CC=CC=3C(C=21)=O)=O)O
Computed Properties
- Exact Mass: 268.03714
- Monoisotopic Mass: 268.03717335g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 446
- 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: 2.7
- Topological Polar Surface Area: 91.7?2
Experimental Properties
- PSA: 91.67
2-Anthracenecarboxaldehyde,9,10-dihydro-1,3-dihydroxy-9,10-dioxo- Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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