Cas no 69008-07-7 (9,10-Anthracenedione, 1,3,6-trihydroxy-)
69008-07-7 structure
Product Name:9,10-Anthracenedione, 1,3,6-trihydroxy-
CAS No:69008-07-7
MF:C14H8O5
MW:256.210324287415
CID:1733172
PubChem ID:9992552
Update Time:2025-04-21
9,10-Anthracenedione, 1,3,6-trihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 9,10-Anthracenedione, 1,3,6-trihydroxy-
- 1,3,6-trihydroxyanthracene-9,10-dione
- DTXSID80433852
- 1,3,6-Trihydroxyanthraquinone
- HTGYRSWFBJFKRE-UHFFFAOYSA-N
- SCHEMBL18130095
- 69008-07-7
-
- Inchi： 1S/C14H8O5/c15-6-1-2-8-9(3-6)13(18)10-4-7(16)5-11(17)12(10)14(8)19/h1-5,15-17H
- InChI Key： HTGYRSWFBJFKRE-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC(=CC=2C(C2C=C(C=C(C=21)O)O)=O)O
Computed Properties
- Exact Mass: 256.03714
- Monoisotopic Mass: 256.03717335g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 407
- 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: 2.8
- Topological Polar Surface Area: 94.8?2
Experimental Properties
- PSA: 94.83
9,10-Anthracenedione, 1,3,6-trihydroxy- Related Literature
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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