1,1-Dimethylethyl α-oxo-1H-imidazole-1-acetate

CAS Registry Number®

75716-83-5
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CAS Name

1,1-Dimethylethyl α-oxo-1H-imidazole-1-acetate

Molecular Formula

C9H12N2O3

Molecular Mass

196.20

Cite this Page

1,1-Dimethylethyl α-oxo-1H-imidazole-1-acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=75716-83-5 (retrieved 2024-09-10) (CAS RN: 75716-83-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    113 °C @ Press: 1.2 Torr

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H12N2O3/c1-9(2,3)14-8(13)7(12)11-5-4-10-6-11/h4-6H,1-3H3

InChIKey

InChIKey=OADVCRKWTJARKI-UHFFFAOYSA-N

SMILES

C(C(OC(C)(C)C)=O)(=O)N1C=CN=C1

Canonical SMILES

O=C(OC(C)(C)C)C(=O)N1C=NC=C1

Other Names for this Substance

  • 1H-Imidazole-1-acetic acid, α-oxo-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl α-oxo-1H-imidazole-1-acetate
  • Imidazol-1-yloxoacetic acid tert-butyl ester
  • Imidazol-1-yloxoacetic acid tert-butyl ester
  • tert-Butyl-2-(1H-imidazol-1-yl)-2-oxoacetate