Cas no 28917-02-4 (9H-Xanthene-1,3-dicarboxylicacid, 8-hydroxy-9-oxo-)
28917-02-4 structure
Product Name:9H-Xanthene-1,3-dicarboxylicacid, 8-hydroxy-9-oxo-
CAS No:28917-02-4
MF:C15H8O7
MW:300.219824790955
CID:276259
PubChem ID:71358891
Update Time:2025-04-19
9H-Xanthene-1,3-dicarboxylicacid, 8-hydroxy-9-oxo- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Xanthene-1,3-dicarboxylicacid, 8-hydroxy-9-oxo-
- 8-hydroxy-9-oxoxanthene-1,3-dicarboxylic acid
- Cassiaxanthone
- Xanthene-1,3-dicarboxylicacid, 8-hydroxy-9-oxo- (8CI)
- 8-HYDROXY-9-OXO-9H-XANTHENE-1,3-DICARBOXYLIC ACID
- DTXSID60782815
- 28917-02-4
-
- Inchi： 1S/C15H8O7/c16-8-2-1-3-9-12(8)13(17)11-7(15(20)21)4-6(14(18)19)5-10(11)22-9/h1-5,16H,(H,18,19)(H,20,21)
- InChI Key： KSDHRLBMSUYFBZ-UHFFFAOYSA-N
- SMILES： O1C2C=CC=C(C=2C(C2C(C(=O)O)=CC(C(=O)O)=CC1=2)=O)O
Computed Properties
- Exact Mass: 300.02694
- Monoisotopic Mass: 300.02700259g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 22
- Rotatable Bond Count: 2
- Complexity: 502
- 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: 2.2
- Topological Polar Surface Area: 121?2
Experimental Properties
- PSA: 121.13
9H-Xanthene-1,3-dicarboxylicacid, 8-hydroxy-9-oxo- Related Literature
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Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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