1-(2-Isocyanato-2-Propanyl)-3-Isopropenylbenzene

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Properties Simple | Detailed

Formula C13H15NO
IUPAC Name 1-(1-isocyanato-1-methyl-ethyl)-3-isopropenyl-benzene
Molecular Mass 201.264 g·mol−1
Heat of Formation -27.4 ± 16.7 kJ·mol−1
Dipole Moment 3.55 ± 1.08 D
Volume 272.79 Å 3
Surface Area 248.75 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(1-isocyanato-1-methylethyl)-3-isopropenylbenzene
  • 1-(2-isocyanatopropan-2-yl)-3-prop-1-en-2-yl-benzene
  • 1-(2-isocyanatopropan-2-yl)-3-prop-1-en-2-ylbenzene
  • 2-(3-(prop-1-en-2-yl)phenyl)prop-2-yl isocyanate
  • 2-(3-(prop-1-en-2-yl)phenyl)prop-2-ylisocyanat [danish]
  • 3-isopropenyl-.alpha.,.alpha.-dimethylbenzyl isocyanate
  • ee4024402
  • isocianato de 2-(3-(prop-1-en-2-il)fenil)prop-2-ilo
  • isocianato de 2-(3-(prop-1-en-2-il)fenil)prop-2-ilo [spanish]
  • isocianato di 2-(3-(prop-1-en-2-il)fenil)prop-2-ile
  • isocyanate de 2-(3-(prop-1-ene-2-yl)phenyl)prop-2-yle
InChIKey ZVEMLYIXBCTVOF-UHFFFAOYSA-N
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