Cas no 722500-53-0 (4H-Pyran-2-carboxylicacid, 6-(ethoxymethyl)-3-hydroxy-4-oxo-)
722500-53-0 structure
Product Name:4H-Pyran-2-carboxylicacid, 6-(ethoxymethyl)-3-hydroxy-4-oxo-
CAS No:722500-53-0
MF:C9H10O6
MW:214.172103404999
CID:558504
PubChem ID:3010946
Update Time:2025-04-19
4H-Pyran-2-carboxylicacid, 6-(ethoxymethyl)-3-hydroxy-4-oxo- Chemical and Physical Properties
Names and Identifiers
-
- 4H-Pyran-2-carboxylicacid, 6-(ethoxymethyl)-3-hydroxy-4-oxo-
- 4H-Pyran-2-carboxylic acid, 6-(ethoxymethyl)-3-hydroxy-4-oxo- (9CI)
- 6-(ethoxymethyl)-3-hydroxy-4-oxopyran-2-carboxylic acid
- DTXSID80388398
- 4H-Pyran-2-carboxylic acid, 6-(ethoxymethyl)-3-hydroxy-4-oxo-
- BDBM50147496
- CHEMBL323046
- 722500-53-0
- 6-Ethoxymethyl-3-hydroxy-4-oxo-4H-pyran-2-carboxylic acid
- 6-(ethoxymethyl)-3-hydroxy-4-oxo-pyran-2-carboxylic acid
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- Inchi： 1S/C9H10O6/c1-2-14-4-5-3-6(10)7(11)8(15-5)9(12)13/h3,11H,2,4H2,1H3,(H,12,13)
- InChI Key： BYYSOMNIVKVLDR-UHFFFAOYSA-N
- SMILES： O1C(C(=O)O)=C(C(C=C1COCC)=O)O
Computed Properties
- Exact Mass: 214.04773803g/mol
- Monoisotopic Mass: 214.04773803g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 352
- 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: 0.3
- Topological Polar Surface Area: 93.1?2
4H-Pyran-2-carboxylicacid, 6-(ethoxymethyl)-3-hydroxy-4-oxo- Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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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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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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