(2S)-3-(4-Methoxyphenyl)-2-(Methylammonio)Propanoate

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Properties Simple | Detailed

Formula C11H15NO3
IUPAC Name (2s)-3-(4-methoxyphenyl)-2-(methylamino)propanoic acid
Molecular Mass 209.242 g·mol−1
Heat of Formation -464.7 ± 16.7 kJ·mol−1
Dipole Moment 3.78 ± 1.08 D
Volume 263.11 Å 3
Surface Area 243.9 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-3-(4-methoxyphenyl)-2-methylammonio-propanoate
  • (2s)-3-(4-methoxyphenyl)-2-methylammonio-propionate
  • (2s)-3-(4-methoxyphenyl)-2-methylammoniopropanoate
  • (2s)-3-(4-methoxyphenyl)-2-methylazaniumyl-propanoate
  • (2s)-3-(4-methoxyphenyl)-2-methylazaniumylpropanoate
InChIKey QESMMBKGCOSBNL-JTQLQIEISA-N
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