Cas no 102474-18-0 ((3E)-3-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)furan-2(3H)-one)
102474-18-0 structure
Product Name:(3E)-3-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)furan-2(3H)-one
CAS No:102474-18-0
MF:C21H20O6
MW:368.379906654358
CID:1134146
PubChem ID:1042336
Update Time:2025-04-20
(3E)-3-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)furan-2(3H)-one Chemical and Physical Properties
Names and Identifiers
-
- (3E)-3-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)furan-2(3H)-one
- 2(3H)-Furanone, 5-(3,4-dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methylene]-, (3E)-
- 3-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)-2(3H)-furanone
- (E)-3-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)-2(3H)-furanone
- 3-(3,4-DIMETHOXY-BENZYLIDENE)-5-(3,4-DIMETHOXY-PHENYL)-3H-FURAN-2-ONE
- 3-(3,4-Dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)furan-2(3H)-one
- MFCD12546752
- (3E)-5-(3,4-dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methylidene]furan-2-one
- (3E)-5-(3,4-Dimethoxyphenyl)-3-[(3,4-dimethoxyphenyl)methylidene]-2,3-dihydrofuran-2-one
- 102474-18-0
-
- Inchi： 1S/C21H20O6/c1-23-16-7-5-13(10-19(16)25-3)9-15-12-18(27-21(15)22)14-6-8-17(24-2)20(11-14)26-4/h5-12H,1-4H3/b15-9+
- InChI Key： YBLQWSNWASKHJP-OQLLNIDSSA-N
- SMILES： O1C(/C(=C/C2C=CC(=C(C=2)OC)OC)/C=C1C1C=CC(=C(C=1)OC)OC)=O
Computed Properties
- Exact Mass: 368.125988g/mol
- Monoisotopic Mass: 368.125988g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 27
- Rotatable Bond Count: 6
- Complexity: 583
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 1
- Undefined Bond Stereocenter Count: 0
- Molecular Weight: 368.4g/mol
- XLogP3: 3.9
- Topological Polar Surface Area: 63.2?2
(3E)-3-(3,4-dimethoxybenzylidene)-5-(3,4-dimethoxyphenyl)furan-2(3H)-one Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
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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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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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