Cas no 192466-95-8 (3(2H)-Furanone,4-hydroxy-2,5-dimethyl-, labeled with carbon-14 (9CI))
192466-95-8 structure
Product Name:3(2H)-Furanone,4-hydroxy-2,5-dimethyl-, labeled with carbon-14 (9CI)
CAS No:192466-95-8
MF:C6H8O3
MW:128.125922203064
CID:116186
Update Time:2025-04-18
3(2H)-Furanone,4-hydroxy-2,5-dimethyl-, labeled with carbon-14 (9CI) Chemical and Physical Properties
Names and Identifiers
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- 3(2H)-Furanone,4-hydroxy-2,5-dimethyl-, labeled with carbon-14 (9CI)
- 4-HYDROXY-2,5-DIMETHYL-3-FURANONE
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- Inchi： 1S/C6H8O3/c1-3-5(7)6(8)4(2)9-3/h3,8H,1-2H3
- InChI Key： INAXVXBDKKUCGI-UHFFFAOYSA-N
- SMILES： O1C(C)=C(O)C(=O)C1C
Computed Properties
- Exact Mass: 128.047
- Monoisotopic Mass: 128.047
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 181
- 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
- Topological Polar Surface Area: 46.5A^2
Experimental Properties
- Color/Form: White to yellowish crystal powder
- Density: 1.05
- Boiling Point: 215.5 oC at 760 mmHg
- Flash Point: 90.5 oC
- Refractive Index: 1.435
3(2H)-Furanone,4-hydroxy-2,5-dimethyl-, labeled with carbon-14 (9CI) Related Literature
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Erbao Chen,Huanlu Song,Yi Li,Haijun Chen,Bao Wang,Xianing Che,Yu Zhang,Shuna Zhao RSC Adv. 2020 10 32276
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Tomas Davidek,Silke Illmann,Andreas Rytz,Imre Blank Food Funct. 2013 4 1105
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Qin Ouyang,Jiewen Zhao,Quansheng Chen,Hao Lin,Zongbao Sun Anal. Methods 2012 4 940
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Probir Kumar Ojha,Kunal Roy RSC Adv. 2018 8 2293
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5. Synthesis of 4-hydroxy-2,5-dimethylfuran-3(2H)-one (furaneol) from (2R,3R)-tartaric acidMark A. Briggs,Alan H. Haines,Haydn F. Jones J. Chem. Soc. Perkin Trans. 1 1985 795
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