3,3-Dimethylbutyl Hydroxy(Diphenyl)Acetate

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Properties Simple | Detailed

Formula C20H24O3
IUPAC Name 3,3-dimethylbutyl 2-hydroxy-2,2-diphenyl-acetate
Molecular Mass 312.403 g·mol−1
Heat of Formation -464.0 ± 16.7 kJ·mol−1
Dipole Moment 2.71 ± 1.08 D
Volume 400.99 Å 3
Surface Area 345.12 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy -0.05 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hydroxy-2,2-di(phenyl)acetic acid 3,3-dimethylbutyl ester
  • 3,3-dimethylbutyl 2-hydroxy-2,2-di(phenyl)acetate
  • 3,3-dimethylbutyl 2-hydroxy-2,2-di(phenyl)ethanoate
  • 3,3-dimethylbutyl alpha-hydroxy-alpha-phenylbenzeneacetate
  • benzeneacetic acid, alpha-hydroxy-alpha-phenyl-, 3,3-dimethylbutyl ester
  • bs 6181
  • bs-6181
CAS Number(s)
  • 16032-05-6
InChIKey RIPLGYSWRIIBGO-UHFFFAOYSA-N
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