Cas no 1438-92-2 (1,2-Propanedione,1-(2-furanyl)-)
1438-92-2 structure
Product Name:1,2-Propanedione,1-(2-furanyl)-
1,2-Propanedione,1-(2-furanyl)- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Propanedione,1-(2-furanyl)-
- 1-(2-furyl)propane-1,2-dione
- 1-(furan-2-yl)propane-1,2-dione
- 1-(2-furanyl)-1,2-propadione
- 1-(2-furanyl)-1,2-propandione
- 1-(2-furanyl)-1,2-propanedione
- 1438-92-2
- 1-(2'-FURYL)PROPANE-1,2-DIONE
- CHEBI:173576
- NS00024674
- alpha-Furyl methyl diketone
- 1,2-Propanedione, 1-(2-furanyl)-
- 1-(uran-2-yl)propane-1,2-dione
- AKOS020762192
- Q27283058
- LLT7R6QD5B
- 1-(2-furyl)-1,2-propanedione
- a-Furyl methyl diketone
- DTXSID20162553
- JXZJRYDTSDCGLO-UHFFFAOYSA-N
- EINECS 215-875-6
- 1,2-PROPANEDIONE, 1-(2-FURYL)-
- (2-furyl)-1,2-propanedione
- UNII-LLT7R6QD5B
- SCHEMBL11538258
-
- Inchi： 1S/C7H6O3/c1-5(8)7(9)6-3-2-4-10-6/h2-4H,1H3
- InChI Key： JXZJRYDTSDCGLO-UHFFFAOYSA-N
- SMILES： O1C=CC=C1C(C(C)=O)=O
Computed Properties
- Exact Mass: 138.03168
- Monoisotopic Mass: 138.032
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 162
- 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: 0.2
- Topological Polar Surface Area: 47.3A^2
Experimental Properties
- Density: 1.176
- Boiling Point: 198.8°Cat760mmHg
- Flash Point: 81.1°C
- Refractive Index: 1.478
- PSA: 47.28
1,2-Propanedione,1-(2-furanyl)- Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
-
Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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