3H-1,2,4-Dioxazole-3-carboxylicacid, 3-(1-methylethyl)-5-phenyl-, methyl ester

Modify Date: 2025-11-11 18:44:41

3H-1,2,4-Dioxazole-3-carboxylicacid, 3-(1-methylethyl)-5-phenyl-, methyl ester Structure
3H-1,2,4-Dioxazole-3-carboxylicacid, 3-(1-methylethyl)-5-phenyl-, methyl ester structure
Common Name 3H-1,2,4-Dioxazole-3-carboxylicacid, 3-(1-methylethyl)-5-phenyl-, methyl ester
CAS Number 64686-53-9 Molecular Weight 249.26200
Density 1.19g/cm3 Boiling Point 297.8ºC at 760mmHg
Molecular Formula C13H15NO4 Melting Point N/A
MSDS N/A Flash Point 114ºC

 Names

Name methyl 5-phenyl-3-propan-2-yl-1,2,4-dioxazole-3-carboxylate

 Chemical & Physical Properties

Density 1.19g/cm3
Boiling Point 297.8ºC at 760mmHg
Molecular Formula C13H15NO4
Molecular Weight 249.26200
Flash Point 114ºC
Exact Mass 249.10000
PSA 57.12000
LogP 1.35590
Index of Refraction 1.537
InChIKey AXKZCGMOHWBGNY-UHFFFAOYSA-N
SMILES COC(=O)C1(C(C)C)N=C(c2ccccc2)OO1

 Synthetic Route

~%

3H-1,2,4-Dioxazole-3-carboxylicacid, 3-(1-methylethyl)-5-phenyl-, methyl ester Structure

3H-1,2,4-Dioxaz...

CAS#:64686-53-9

Literature: Graziano,M.L. et al. Synthesis, 1977 , p. 572 - 573

 Precursor & DownStream

Precursor  1

DownStream  0

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