Cas no 99246-63-6 ((4,6-dimethoxy-3-methyl-2-benzofuranyl)phenylMethanone)
99246-63-6 structure
Product Name:(4,6-dimethoxy-3-methyl-2-benzofuranyl)phenylMethanone
CAS No:99246-63-6
MF:C18H16O4
MW:296.317245483398
CID:2103080
PubChem ID:689064
Update Time:2025-04-21
(4,6-dimethoxy-3-methyl-2-benzofuranyl)phenylMethanone Chemical and Physical Properties
Names and Identifiers
-
- (4,6-dimethoxy-3-methyl-2-benzofuranyl)phenylMethanone
- (4,6-dimethoxy-3-methyl-1-benzofuran-2-yl)(phenyl)methanone
- AKOS024306994
- 669-261-1
- DA-19904
- AQ-358/41272817
- 99246-63-6
- (4,6-dimethoxy-3-methyl-1-benzofuran-2-yl)-phenylmethanone
- (4,6-Dimethoxy-3-methylbenzofuran-2-yl)(phenyl)methanone
-
- Inchi： 1S/C18H16O4/c1-11-16-14(21-3)9-13(20-2)10-15(16)22-18(11)17(19)12-7-5-4-6-8-12/h4-10H,1-3H3
- InChI Key： QLDFAKUGHBXLGN-UHFFFAOYSA-N
- SMILES： O1C(C(C2C=CC=CC=2)=O)=C(C)C2C(=CC(=CC1=2)OC)OC
Computed Properties
- Exact Mass: 296.10485899Da
- Monoisotopic Mass: 296.10485899Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 391
- 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: 4.3
- Topological Polar Surface Area: 48.7?2
(4,6-dimethoxy-3-methyl-2-benzofuranyl)phenylMethanone Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
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