Neotame

Molecule SVG Image

Properties Simple | Detailed

Formula C20H30N2O5
IUPAC Name (3s)-4-[[(1s)-1-benzyl-2-methoxy-2-oxo-ethyl]amino]-3-(3,3-dimethylbutylamino)-4-oxo-butanoic acid
Molecular Mass 378.463 g·mol−1
Heat of Formation -960.2 ± 16.7 kJ·mol−1
Dipole Moment 2.21 ± 1.08 D
Volume 489.62 Å 3
Surface Area 391.56 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy 0.09 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-3-(3,3-dimethylbutylamino)-4-[[(1s)-2-methoxy-2-oxo-1-(phenylmethyl)ethyl]amino]-4-oxo-butanoic acid
  • (3s)-3-(3,3-dimethylbutylamino)-4-[[(1s)-2-methoxy-2-oxo-1-(phenylmethyl)ethyl]amino]-4-oxobutanoic acid
  • (3s)-3-(3,3-dimethylbutylamino)-4-[[(2s)-1-methoxy-1-oxo-3-phenyl-propan-2-yl]amino]-4-oxo-butanoic acid
  • (3s)-3-(3,3-dimethylbutylamino)-4-[[(2s)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxobutanoic acid
  • (3s)-4-[[(1s)-1-(benzyl)-2-keto-2-methoxy-ethyl]amino]-3-(3,3-dimethylbutylamino)-4-keto-butyric acid
InChIKey HLIAVLHNDJUHFG-HOTGVXAUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N