Cas no 24056-48-2 (4H-Pyran-2-carboxylicacid, 5-hydroxy-6-methyl-4-oxo-, ethyl ester)
24056-48-2 structure
Product Name:4H-Pyran-2-carboxylicacid, 5-hydroxy-6-methyl-4-oxo-, ethyl ester
4H-Pyran-2-carboxylicacid, 5-hydroxy-6-methyl-4-oxo-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- 4H-Pyran-2-carboxylicacid, 5-hydroxy-6-methyl-4-oxo-, ethyl ester
- Ethyl 5-hydroxy-6-methyl-4-oxo-4H-pyran-2-carboxylate
- ethyl 5-hydroxy-6-methyl-4-oxopyran-2-carboxylate
- EINECS 246-001-1
- DTXSID40178797
- 24056-48-2
- NS00027547
-
- Inchi： 1S/C9H10O5/c1-3-13-9(12)7-4-6(10)8(11)5(2)14-7/h4,11H,3H2,1-2H3
- InChI Key： LXHGALLQKKIMAZ-UHFFFAOYSA-N
- SMILES： O1C(C(=O)OCC)=CC(C(=C1C)O)=O
Computed Properties
- Exact Mass: 198.0528
- Monoisotopic Mass: 198.052823
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 337
- 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
- Surface Charge: 0
- Tautomer Count: 9
- XLogP3: 0.8
- Topological Polar Surface Area: 72.8
Experimental Properties
- Density: 1.36
- Boiling Point: 362.7°C at 760 mmHg
- Flash Point: 147.3°C
- Refractive Index: 1.542
- PSA: 72.83
4H-Pyran-2-carboxylicacid, 5-hydroxy-6-methyl-4-oxo-, ethyl ester Related Literature
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1. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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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
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