N~2~-(4-Hydroxyphenyl)-N~2~-Methyl-L-Glutamine

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Properties Simple | Detailed

Formula C12H16N2O4
IUPAC Name (2s)-5-amino-2-(4-hydroxy-n-methyl-anilino)-5-oxo-pentanoic acid
Molecular Mass 252.266 g·mol−1
Heat of Formation -681.4 ± 16.7 kJ·mol−1
Dipole Moment 3.98 ± 1.08 D
Volume 301.96 Å 3
Surface Area 267.86 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy 0.15 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-5-amino-2-[(4-hydroxyphenyl)-methyl-amino]-5-keto-valeric acid
  • (2s)-5-amino-2-[(4-hydroxyphenyl)-methyl-amino]-5-oxo-pentanoic acid
  • (2s)-5-amino-2-[(4-hydroxyphenyl)-methylamino]-5-oxopentanoic acid
  • l-glutamine, n-(4-hydroxyphenyl)-n-methyl-
  • n(2)-methyl-gamma-l-glutaminyl-4-hydroxybenzene
  • nmgghb
CAS Number(s)
  • 75596-72-4
InChIKey LJEQJKDRBQGIOF-JTQLQIEISA-N
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