Cas no 659737-93-6 (9H-Xanthen-9-one, 1,3,6-trihydroxy-8-methoxy-)
659737-93-6 structure
Product Name:9H-Xanthen-9-one, 1,3,6-trihydroxy-8-methoxy-
CAS No:659737-93-6
MF:C14H10O6
MW:274.225604534149
CID:1697628
PubChem ID:71375282
Update Time:2025-04-21
9H-Xanthen-9-one, 1,3,6-trihydroxy-8-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Xanthen-9-one, 1,3,6-trihydroxy-8-methoxy-
- 1,3,6-trihydroxy-8-methoxyxanthen-9-one
- DTXSID70798028
- 1,3,6-TRIHYDROXY-8-METHOXY-9H-XANTHEN-9-ONE
- 659737-93-6
- 1,3,6-trihydroxy-8-methoxyxanthone
-
- Inchi： 1S/C14H10O6/c1-19-9-3-7(16)5-11-13(9)14(18)12-8(17)2-6(15)4-10(12)20-11/h2-5,15-17H,1H3
- InChI Key： FTDPMUIYQFTFJU-UHFFFAOYSA-N
- SMILES： O1C2C=C(C=C(C=2C(C2C(=CC(=CC1=2)O)OC)=O)O)O
Computed Properties
- Exact Mass: 274.0477
- Monoisotopic Mass: 274.04773803g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 1
- Complexity: 386
- 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: 2.4
- Topological Polar Surface Area: 96.2?2
Experimental Properties
- PSA: 96.22
9H-Xanthen-9-one, 1,3,6-trihydroxy-8-methoxy- Related Literature
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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