N~2~-(3,4-Dihydroxyphenyl)-N~2~-Methyl-L-Glutamine

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Properties Simple | Detailed

Formula C12H16N2O5
IUPAC Name (2s)-5-amino-2-(3,4-dihydroxy-n-methyl-anilino)-5-oxo-pentanoic acid
Molecular Mass 268.266 g·mol−1
Heat of Formation -855.4 ± 16.7 kJ·mol−1
Dipole Moment 2.04 ± 1.08 D
Volume 310.11 Å 3
Surface Area 275.03 Å 2
HOMO Energy -8.38 ± 0.55 eV
LUMO Energy 3.12 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-5-amino-2-[(3,4-dihydroxyphenyl)-methyl-amino]-5-keto-valeric acid
  • (2s)-5-amino-2-[(3,4-dihydroxyphenyl)-methyl-amino]-5-oxo-pentanoic acid
  • (2s)-5-amino-2-[(3,4-dihydroxyphenyl)-methylamino]-5-oxopentanoic acid
  • l-glutamine, n-(3,4-dihydroxyphenyl)-n(2)-methyl-
  • l-glutamine, n-(3,4-dihydroxyphenyl)-n2-methyl-
  • methylagaridoxin
  • n(2)-methyl-gamma-l-glutaminyl-3,4-dihydroxybenzene
CAS Number(s)
  • 76500-09-9
InChIKey DOACJPGLGGWIGS-QMMMGPOBSA-N
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