(2S)-Hydroxy(4-Hydroxyphenyl)Acetonitrile

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Properties Simple | Detailed

Formula C8H7NO2
IUPAC Name (2s)-2-hydroxy-2-(4-hydroxyphenyl)acetonitrile
Molecular Mass 149.147 g·mol−1
Heat of Formation -140.7 ± 16.7 kJ·mol−1
Dipole Moment 3.35 ± 1.08 D
Volume 178.59 Å 3
Surface Area 180.66 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy 2.77 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-hydroxy-2-(4-hydroxyphenyl)acetonitrile
  • (2s)-2-hydroxy-2-(4-hydroxyphenyl)ethanenitrile
  • (2s)-hydroxy(4-hydroxyphenyl)ethanenitrile
  • (s)-4-hydroxymandelonitrile
  • alpha,4-dihydroxybenzeneacetonitrile
  • dhr
CAS Number(s)
  • 13093-65-7
InChIKey HOOOPXDSCKBLFG-MRVPVSSYSA-N
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