Cas no 71064-07-8 (1,2-Benzisoxazole, 4,6-dimethoxy-)
71064-07-8 structure
Product Name:1,2-Benzisoxazole, 4,6-dimethoxy-
CAS No:71064-07-8
MF:C9H9NO3
MW:179.172662496567
CID:2106782
Update Time:2023-08-03
1,2-Benzisoxazole, 4,6-dimethoxy- Chemical and Physical Properties
Names and Identifiers
-
- 4,6-dimethoxy-1,2-Benzisoxazole
- 1,2-Benzisoxazole, 4,6-dimethoxy-
- WDVYLYYDNBRGFU-UHFFFAOYSA-N
-
- Inchi： 1S/C9H9NO3/c1-11-6-3-8(12-2)7-5-10-13-9(7)4-6/h3-5H,1-2H3
- InChI Key： WDVYLYYDNBRGFU-UHFFFAOYSA-N
- SMILES： O1C2C=C(C=C(C=2C=N1)OC)OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 176
- Topological Polar Surface Area: 44.5
1,2-Benzisoxazole, 4,6-dimethoxy- Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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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
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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