Cas no 60998-59-6 (2(3H)-Benzofuranone, 4,5,6,7-tetramethyl-)
60998-59-6 structure
Product Name:2(3H)-Benzofuranone, 4,5,6,7-tetramethyl-
CAS No:60998-59-6
MF:C12H14O2
MW:190.238363742828
CID:494595
PubChem ID:595374
Update Time:2025-04-19
2(3H)-Benzofuranone, 4,5,6,7-tetramethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2(3H)-Benzofuranone, 4,5,6,7-tetramethyl-
- 4,5,6,7-tetramethyl-3H-1-benzofuran-2-one
-
- Inchi： 1S/C12H14O2/c1-6-7(2)9(4)12-10(8(6)3)5-11(13)14-12/h5H2,1-4H3
- InChI Key： ZRJOZLVUOJRDDF-UHFFFAOYSA-N
- SMILES： O1C(CC2=C1C(C)=C(C)C(C)=C2C)=O
Computed Properties
- Exact Mass: 190.09942
- Monoisotopic Mass: 190.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 0
- Complexity: 249
- 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: 2.8
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
2(3H)-Benzofuranone, 4,5,6,7-tetramethyl- Related Literature
-
Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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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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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
60998-59-6 (2(3H)-Benzofuranone, 4,5,6,7-tetramethyl-) Related Products
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