Cas no 5436-14-6 (2,4(3H,5H)-Furandione,3-ethyl-)
5436-14-6 structure
Product Name:2,4(3H,5H)-Furandione,3-ethyl-
2,4(3H,5H)-Furandione,3-ethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2,4(3H,5H)-Furandione,3-ethyl-
- 3-ethyloxolane-2,4-dione
- 2-Aethyl-4-hydroxy-acetessigsaeure-lacton
- 3-ethyl-2,4(3H,5H)-furandione
- 3-ethyl-furan-2,4-dione
- 3-Ethyl-tetronsaeure
- AC1L5G82
- AC1Q6EU1
- AR-1F3051
- CTK5A0637
- NSC21365
- SureCN1742051
- SCHEMBL1742051
- 3-Ethyl-2,4(3H,5H)-furandione #
- 2,5H)-Furandione, 3-ethyl-
- IEGPSTVVCRQXBD-UHFFFAOYSA-N
- DTXSID50901497
- NoName_623
- 5436-14-6
- NSC-21365
- 2,4(3H,5H)-Furandione, 3-ethyl-
- DTXSID10281348
-
- Inchi: 1S/C6H8O3/c1-2-4-5(7)3-9-6(4)8/h4H,2-3H2,1H3
- InChI Key: IEGPSTVVCRQXBD-UHFFFAOYSA-N
- SMILES: O1C(C(C(C1)=O)CC)=O
Computed Properties
- Exact Mass: 128.04734
- Monoisotopic Mass: 128.047
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 1
- Complexity: 150
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.8
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- Density: 1.161
- Boiling Point: 292.6°Cat760mmHg
- Flash Point: 131.6°C
- Refractive Index: 1.449
- PSA: 43.37
- LogP: 0.13850
2,4(3H,5H)-Furandione,3-ethyl- Related Literature
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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