Cas no 478-06-8 (2-Anthracenecarboxylicacid, 9,10-dihydro-1,3-dihydroxy-9,10-dioxo-)
478-06-8 structure
Product Name:2-Anthracenecarboxylicacid, 9,10-dihydro-1,3-dihydroxy-9,10-dioxo-
2-Anthracenecarboxylicacid, 9,10-dihydro-1,3-dihydroxy-9,10-dioxo- Chemical and Physical Properties
Names and Identifiers
-
- 2-Anthracenecarboxylicacid, 9,10-dihydro-1,3-dihydroxy-9,10-dioxo-
- 1,3-dihydroxy-9,10-dioxoanthracene-2-carboxylic acid
- MUNJISTIN
- 1,3-Dihydroxy-9,10-dioxo-9,10-dihydro-anthracen-2-carbonsaeure
- 1,3-dihydroxy-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid
- 1,3-dihydroxy-9,10-dioxo-9,10-dihydro-anthracene-2-carboxylic acid
- 1.3-Dioxy-anthrachinon-carbonsaeure-(2)
- 2-carboxy-1,3-dihydroxyanthraquinone
- AC1L4NOS
- AC1Q6JWU
- CCRIS 6444
- CTK1D5987
- KST-1B5277
- KST-1B5279
- Purpuroxanthin-carbonsaeure-(2)
- SureCN6548219
- 478-06-8
- 1,3-dihydroxyanthraquinone-2-carboxylic acid
- DTXSID50197277
- A21426
- SCHEMBL6548219
-
- Inchi： 1S/C15H8O6/c16-9-5-8-10(14(19)11(9)15(20)21)13(18)7-4-2-1-3-6(7)12(8)17/h1-5,16,19H,(H,20,21)
- InChI Key： PLDISGVCDWLKQC-UHFFFAOYSA-N
- SMILES： OC1=C(C(=O)O)C(=CC2C(C3C=CC=CC=3C(C=21)=O)=O)O
Computed Properties
- Exact Mass: 284.032088
- Monoisotopic Mass: 284.032088
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 1
- Complexity: 487
- 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: 17
- XLogP3: 2.8
- Topological Polar Surface Area: 112
Experimental Properties
- Density: 1.687
- Boiling Point: 522.8°Cat760mmHg
- Flash Point: 284.1°C
- Refractive Index: 1.76
2-Anthracenecarboxylicacid, 9,10-dihydro-1,3-dihydroxy-9,10-dioxo- Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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