Cas no 23429-05-2 (2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-)
23429-05-2 structure
Product Name:2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-
2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl- Chemical and Physical Properties
Names and Identifiers
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- 2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-
- Vitamin B6 Impurity 14
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- Inchi： 1S/C7H9NO4/c1-3-11-7-4(2)8-5(12-7)6(9)10/h3H2,1-2H3,(H,9,10)
- InChI Key： BDXXPIZNQMLMBS-UHFFFAOYSA-N
- SMILES： O1C(OCC)=C(C)N=C1C(O)=O
Computed Properties
- Exact Mass: 171.05315777g/mol
- Monoisotopic Mass: 171.05315777g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 173
- 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: 1.3
- Topological Polar Surface Area: 72.6?2
2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl- Related Literature
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
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2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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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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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
23429-05-2 (2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-) Related Products
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