Cas no 128341-04-8 (9,10-Anthracenedione,4,5-dihydroxy-1-(hydroxymethyl)-)
128341-04-8 structure
Product Name:9,10-Anthracenedione,4,5-dihydroxy-1-(hydroxymethyl)-
CAS No:128341-04-8
MF:C15H10O5
MW:270.236904621124
CID:164859
PubChem ID:124869
Update Time:2025-04-19
9,10-Anthracenedione,4,5-dihydroxy-1-(hydroxymethyl)- Chemical and Physical Properties
Names and Identifiers
-
- 9,10-Anthracenedione,4,5-dihydroxy-1-(hydroxymethyl)-
- 4,5-dihydroxy-1-(hydroxymethyl)anthracene-9,10-dione
- 1,8-Dihydroxy-4-hydroxymethylanthraquinone
- 4,5-Dihydroxy-1-(hydroxymethyl)-9,10-anthracenedione
- DHHMA
- DTXSID70155854
- 9,10-Anthracenedione, 4,5-dihydroxy-1-(hydroxymethyl)-
- 1,8-Dihydroxy-4-hydroxymethyl anthraquinone
- 128341-04-8
- SCHEMBL3271835
-
- Inchi： 1S/C15H10O5/c16-6-7-4-5-10(18)13-11(7)14(19)8-2-1-3-9(17)12(8)15(13)20/h1-5,16-18H,6H2
- InChI Key： WLOAMJAMSFVOOZ-UHFFFAOYSA-N
- SMILES： O=C1C2C=CC=C(C=2C(C2=C(C=CC(CO)=C21)O)=O)O
Computed Properties
- Exact Mass: 270.0528
- Monoisotopic Mass: 270.053
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 421
- 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
- Surface Charge: 0
- Tautomer Count: 24
- XLogP3: 1.8
- Topological Polar Surface Area: 94.8?2
Experimental Properties
- Density: 1.592
- Boiling Point: 571.6°Cat760mmHg
- Flash Point: 313.6°C
- Refractive Index: 1.746
- PSA: 94.83
9,10-Anthracenedione,4,5-dihydroxy-1-(hydroxymethyl)- Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
-
Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
128341-04-8 (9,10-Anthracenedione,4,5-dihydroxy-1-(hydroxymethyl)-) Related Products
- 481-72-1(Aloe emodin)
- 481-74-3(Chrysophanol)
- 129-43-1(1-Hydroxyanthracene-9,10-dione)
- 24094-45-9(9,10-Anthracenedione,1-hydroxy-2-(hydroxymethyl)-)
- 81-60-7(1,4,5,8-Tetrahydroxyanthra-9,10-quinone)
- 81-64-1(Quinizarin)
- 478-43-3(Rhein)
- 117-12-4(Anthrarufin 85%)
- 117-10-2(Danthron)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
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