4-[3-Amino-1-(4-Hydroxyphenyl)Butyl]-2-Methylphenol

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Properties Simple | Detailed

Formula C17H21NO2
IUPAC Name 4-[(1r,3r)-3-amino-1-(4-hydroxyphenyl)butyl]-2-methyl-phenol
Molecular Mass 271.354 g·mol−1
Heat of Formation -287.1 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 348.05 Å 3
Surface Area 308.18 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 0.20 ± eV
Point Group Symmetry C1
InChIKey QQXUACLYCIWJIU-MLGOLLRUSA-N
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