Methyl 1-[(1R)-1-Phenylethyl]-1H-Imidazole-5-Carboxylate

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Properties Simple | Detailed

Formula C13H14N2O2
IUPAC Name methyl 3-[(1r)-1-phenylethyl]imidazole-4-carboxylate
Molecular Mass 230.262 g·mol−1
Heat of Formation -130.6 ± 16.7 kJ·mol−1
Dipole Moment 2.96 ± 1.08 D
Volume 283.33 Å 3
Surface Area 257.74 Å 2
HOMO Energy -9.66 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
Synonyms
  • 3-[(1r)-1-phenylethyl]-4-imidazolecarboxylic acid methyl ester
  • 3-[(1r)-1-phenylethyl]imidazole-4-carboxylic acid methyl ester
  • methyl 3-[(1r)-1-phenylethyl]imidazole-4-carboxylate
InChIKey FHFZEKYDSVTYLL-SNVBAGLBSA-N
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