Cas no 61234-64-8 (9H-Xanthen-9-one, 1,6-dimethoxy-5-methyl-)
61234-64-8 structure
Product Name:9H-Xanthen-9-one, 1,6-dimethoxy-5-methyl-
CAS No:61234-64-8
MF:C16H14O4
MW:270.279964923859
CID:487508
PubChem ID:71397922
Update Time:2025-04-19
9H-Xanthen-9-one, 1,6-dimethoxy-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 9H-Xanthen-9-one, 1,6-dimethoxy-5-methyl-
- 1,6-dimethoxy-5-methylxanthen-9-one
- DTXSID50819381
- 1,6-DIMETHOXY-5-METHYL-9H-XANTHEN-9-ONE
- 61234-64-8
-
- Inchi： 1S/C16H14O4/c1-9-11(18-2)8-7-10-15(17)14-12(19-3)5-4-6-13(14)20-16(9)10/h4-8H,1-3H3
- InChI Key： XJEUJRBUGKUUBN-UHFFFAOYSA-N
- SMILES： O1C2C=CC=C(C=2C(C2C=CC(=C(C)C1=2)OC)=O)OC
Computed Properties
- Exact Mass: 270.08922
- Monoisotopic Mass: 270.08920892g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 20
- Rotatable Bond Count: 2
- Complexity: 370
- 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: 3.3
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
9H-Xanthen-9-one, 1,6-dimethoxy-5-methyl- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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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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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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