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CAS Number: 144689-94-1
diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate

Structure

diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate
Name: diethyl 2-propyl-1H-imidazole-4,5-dicarboxylate
Synonyms:
General Information
Product Number: 144689941
CAS Registry Number: 144689-94-1
Name:
        1H-​Imidazole-​4,​5-​dicarboxylic acid, 2-​propyl-​, 4,​5-​diethyl ester
        1H-​Imidazole-​4,​5-​dicarboxylic acid, 2-​propyl-​, diethyl ester (9CI); Diethyl 2-​propyl-​1H-​imidazole-​4,​5-​dicarboxylate; Diethyl 2-​propylimidazole-​4,​5-​dicarboxylate 
 
Chemical Formula: C12H18N2O4
Exact Mass: 254.13
Molecular Weight: 254.28
m/z: 254.13 (100.0%), 255.13 (13.3%), 256.13 (1.7%)
Elemental Analysis: C, 56.68; H, 7.13; N, 11.02; O, 25.17
 
InChI: InChI=1S/C12H18N2O4/c1-4-7-8-13-9(11(15)17-5-2)10(14-8)12(16)18-6-3/h4-7H2,1-3H3,(H,13,14)
InChIKey: ZQPMIDPIXSMOAD-UHFFFAOYSA-N
Canonical SMILES : CCCC1=NC(=C(N1)C(=O)OCC)C(=O)OCC
 
Thermal Properties Value Condition Note
Melting Point 83-85 °C   (1)CAS

Specification

98%

References

  • (1) Wen, Xinmin; Organic Preparations and Procedures International 2006, V38(4), P410-412 CAPLUS
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