3-(1H-Imidazol-5-Yl)Propyl Benzylcarbamate

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Properties Simple | Detailed

Formula C14H17N3O2
IUPAC Name 3-(1h-imidazol-5-yl)propyl n-benzylcarbamate
Molecular Mass 259.304 g·mol−1
Heat of Formation -176.4 ± 16.7 kJ·mol−1
Dipole Moment 4.21 ± 1.08 D
Volume 320.2 Å 3
Surface Area 306.91 Å 2
HOMO Energy -9.35 ± 0.55 eV
LUMO Energy 2.92 ± eV
Point Group Symmetry C1
Synonyms
  • 3-(3h-imidazol-4-yl)propyl n-(phenylmethyl)carbamate
  • n-(benzyl)carbamic acid 3-(3h-imidazol-4-yl)propyl ester
  • n-(phenylmethyl)carbamic acid 3-(3h-imidazol-4-yl)propyl ester
InChIKey FWMILSQSUZBVOK-UHFFFAOYSA-N
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