Cas no 55386-63-5 (9H-Xanthen-9-one, 1,5-dihydroxy-2,3-dimethoxy-)
55386-63-5 structure
Product Name:9H-Xanthen-9-one, 1,5-dihydroxy-2,3-dimethoxy-
CAS No:55386-63-5
MF:C15H12O6
MW:288.252184867859
CID:352045
PubChem ID:11580116
Update Time:2025-04-19
9H-Xanthen-9-one, 1,5-dihydroxy-2,3-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Xanthen-9-one, 1,5-dihydroxy-2,3-dimethoxy-
- 1,5-dihydroxy-2,3-dimethoxyxanthen-9-one
- SCHEMBL16244513
- 55386-63-5
- DTXSID00468924
-
- Inchi： 1S/C15H12O6/c1-19-10-6-9-11(13(18)15(10)20-2)12(17)7-4-3-5-8(16)14(7)21-9/h3-6,16,18H,1-2H3
- InChI Key： APPOIVIWJAIHBI-UHFFFAOYSA-N
- SMILES： O1C2C(=CC=CC=2C(C2C(=C(C(=CC1=2)OC)OC)O)=O)O
Computed Properties
- Exact Mass: 288.06336
- Monoisotopic Mass: 288.06338810g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 21
- Rotatable Bond Count: 2
- Complexity: 400
- 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: 2.7
- Topological Polar Surface Area: 85.2?2
Experimental Properties
- PSA: 85.22
9H-Xanthen-9-one, 1,5-dihydroxy-2,3-dimethoxy- Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
55386-63-5 (9H-Xanthen-9-one, 1,5-dihydroxy-2,3-dimethoxy-) Related Products
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