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Structure

Isoxazole-4-carboxylic acid ethyl ester

CAS
80370-40-7
Catalog Number
ACM80370407
Category
Other Products
Molecular Weight
141.12
Molecular Formula
C6H7NO3

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Specification

Synonyms
80370-40-7, ETHYL ISOXAZOLE-4-CARBOXYLATE, 4-Isoxazolecarboxylic acid ethyl ester, ISOXAZOLE-4-CARBOXYLIC ACID ETHYL ESTER, Ethyl 4-isoxazolecarboxylic acid, ethyl 1,2-oxazole-4-carboxylate, AG-H-23084, PubChem24246, ACMC-209pjc, AGN-PC-00PSVJ, SureCN8094744, 3-ethylisoxazole-4-carboxylate, CTK5E7722, MolPort-000-141-155, ACT01863, ANW-37366, ZINC04208879, 4-Isoxazolecarboxylicacid, ethyl ester, AKOS006286528, AM90129
IUPAC Name
ethyl 1,2-oxazole-4-carboxylate
Canonical SMILES
CCOC(=O)C1=CON=C1
InChI Key
SNBLIYQEFSVZLK-UHFFFAOYSA-N
Boiling Point
219.5ºC at 760 mmHg
Flash Point
86.6ºC
Density
1.177 g/cm³
Exact Mass
141.04300
H-Bond Acceptor
4
H-Bond Donor
0

Upstream Synthesis Route 1

  • 80370-42-9
  • 80370-40-7

Reference: [1]Gazzetta Chimica Italiana,1947,vol. 77,p. 206,212
[2]Tetrahedron Letters,1981,vol. 22,p. 3451 - 3454

Upstream Synthesis Route 2

  • 64-17-5
  • 68776-58-9
  • 80370-40-7

Reference: [1]Angus, Richard O.; Bryce, Martin R.; Keshavarz-K., M.; Wudl, Fred
[Synthesis, 1988, # 9, p. 746 - 748]

Downstream Synthesis Route 1

  • 80370-40-7
  • 6436-62-0

Reference: [1] Tetrahedron Letters, 1981, vol. 22, # 36, p. 3451 - 3454
[2] Gazzetta Chimica Italiana, 1947, vol. 77, p. 206,212

Downstream Synthesis Route 2

  • 80370-40-7
  • 6436-62-0

Reference: [1]Tetrahedron Letters,1981,vol. 22,p. 3451 - 3454
[2]Gazzetta Chimica Italiana,1947,vol. 77,p. 206,212

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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