4-[3-(Tert-Butylamino)-2-Hydroxypropoxy]-5-Fluorobenzene-1,2-Diol

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Properties Simple | Detailed

Formula C13H20FNO4
IUPAC Name 4-[(2s)-3-(tert-butylamino)-2-hydroxy-propoxy]-5-fluoro-benzene-1,2-diol
Molecular Mass 273.301 g·mol−1
Heat of Formation -906.4 ± 16.7 kJ·mol−1
Dipole Moment 3.22 ± 1.08 D
Volume 333.75 Å 3
Surface Area 283.69 Å 2
HOMO Energy -8.73 ± 0.55 eV
LUMO Energy -0.41 ± eV
Point Group Symmetry C1
InChIKey JEUSMJOCKAGUHH-QMMMGPOBSA-N
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