Cas no 26071-13-6 (2-Anthracenecarboxylicacid, 9,10-dihydro-1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxo-)
26071-13-6 structure
Product Name:2-Anthracenecarboxylicacid, 9,10-dihydro-1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxo-
CAS No:26071-13-6
MF:C17H12O7
MW:328.272985458374
CID:289828
PubChem ID:71359083
Update Time:2025-04-19
2-Anthracenecarboxylicacid, 9,10-dihydro-1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxo- Chemical and Physical Properties
Names and Identifiers
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- 2-Anthracenecarboxylicacid, 9,10-dihydro-1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxo-
- 1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxoanthracene-2-carboxylic acid
- 2-Anthroicacid, 9,10-dihydro-1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxo- (8CI)
- Dermolutein
- 26071-13-6
- 1,6-DIHYDROXY-8-METHOXY-3-METHYL-9,10-DIOXO-9,10-DIHYDROANTHRACENE-2-CARBOXYLIC ACID
- SCHEMBL23199056
- 8-methoxy-3-methyl-1,6-dihydroxy-anthraquinone-2-carboxylic acid
- DTXSID40782954
-
- Inchi: 1S/C17H12O7/c1-6-3-8-13(15(20)11(6)17(22)23)16(21)12-9(14(8)19)4-7(18)5-10(12)24-2/h3-5,18,20H,1-2H3,(H,22,23)
- InChI Key: VDSHLGLMZNUPSJ-UHFFFAOYSA-N
- SMILES: O(C)C1=CC(=CC2C(C3C=C(C)C(C(=O)O)=C(C=3C(C=21)=O)O)=O)O
Computed Properties
- Exact Mass: 328.05826
- Monoisotopic Mass: 328.05830272g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 24
- Rotatable Bond Count: 2
- Complexity: 559
- 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: 2.6
- Topological Polar Surface Area: 121?2
Experimental Properties
- PSA: 121.13
2-Anthracenecarboxylicacid, 9,10-dihydro-1,6-dihydroxy-8-methoxy-3-methyl-9,10-dioxo- Related Literature
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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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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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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