N~2~-{[(4-Bromobenzyl)Oxy]Carbonyl}-N-[(2S)-1-Oxo-2-Hexanyl]-L-Leucinamide

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Formula C20H29BrN2O4
IUPAC Name (4-bromophenyl)methyl n-[(1s)-1-[[(1s)-1-formylpentyl]carbamoyl]-3-methyl-butyl]carbamate
Molecular Mass 441.359 g·mol−1
Heat of Formation -784.9 ± 16.7 kJ·mol−1
Dipole Moment 6.49 ± 1.08 D
Volume 505.59 Å 3
Surface Area 381.62 Å 2
HOMO Energy -9.65 ± 0.55 eV
LUMO Energy 2.39 ± eV
Point Group Symmetry C1
Synonyms
  • (4-bromophenyl)methyl n-[(1s)-1-[[(1s)-1-formylpentyl]carbamoyl]-3-methyl-butyl]carbamate
  • (4-bromophenyl)methyl n-[(2s)-4-methyl-1-oxo-1-[[(2s)-1-oxohexan-2-yl]amino]pentan-2-yl]carbamate
  • mye
  • n-[(1s)-1-[[(1s)-1-formylpentyl]carbamoyl]-3-methyl-butyl]carbamic acid (4-bromobenzyl) ester
  • n-[(1s)-1-[[[(1s)-1-formylpentyl]amino]-oxomethyl]-3-methylbutyl]carbamic acid (4-bromophenyl)methyl ester
  • n2-({[(4-bromophenyl)methyl]oxy}carbonyl)-n1-[(1s)-1-formylpentyl]-l-leucinamide
InChIKey UEDKSAKLZBMNMA-ROUUACIJSA-N
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Elements H C Br O N