Ethyl 2,3-dihydro-5-methyl-ε,2-dioxo-1H-imidazole-4-hexanoate

CAS Registry Number®

39215-52-6
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CAS Name

Ethyl 2,3-dihydro-5-methyl-ε,2-dioxo-1H-imidazole-4-hexanoate

Molecular Formula

C12H18N2O4

Molecular Mass

254.28

Cite this Page

Ethyl 2,3-dihydro-5-methyl-ε,2-dioxo-1H-imidazole-4-hexanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=39215-52-6 (retrieved 2024-09-11) (CAS RN: 39215-52-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    171.5-173 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H18N2O4/c1-3-18-10(16)7-5-4-6-9(15)11-8(2)13-12(17)14-11/h3-7H2,1-2H3,(H2,13,14,17)

InChIKey

InChIKey=QKLTUZKTQSIWKO-UHFFFAOYSA-N

SMILES

C(CCCCC(OCC)=O)(=O)C1=C(C)NC(=O)N1

Canonical SMILES

O=C1NC(C(=O)CCCCC(=O)OCC)=C(N1)C

Other Names for this Substance

  • 1H-Imidazole-4-hexanoic acid, 2,3-dihydro-5-methyl-ε,2-dioxo-, ethyl ester
  • Ethyl 2,3-dihydro-5-methyl-ε,2-dioxo-1H-imidazole-4-hexanoate
  • α-Oxodehydrodesthiobiotin
  • Ketodehydrodethiobiotin ethyl ester