4-[(2-Bromo-2-Methylpropanoyl)Amino]-L-Phenylalanine

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Properties Simple | Detailed

Formula C13H17BrN2O3
IUPAC Name (2s)-2-amino-3-[4-[(2-bromo-2-methyl-propanoyl)amino]phenyl]propanoic acid
Molecular Mass 329.190 g·mol−1
Heat of Formation -534.6 ± 16.7 kJ·mol−1
Dipole Moment 2.18 ± 1.08 D
Volume 341.04 Å 3
Surface Area 307.56 Å 2
HOMO Energy -8.92 ± 0.55 eV
LUMO Energy -0.63 ± eV
Point Group Symmetry C1
InChIKey ZKDRICVKKZOGNC-JTQLQIEISA-N
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Elements H C O Br N