Isobutyl Chloroformate

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Properties Simple | Detailed

Formula C5H9ClO2
IUPAC Name isobutyl carbonochloridate
Molecular Mass 136.577 g·mol−1
Heat of Formation -459.8 ± 16.7 kJ·mol−1
Dipole Moment 3.47 ± 1.08 D
Volume 162.7 Å 3
Surface Area 169.24 Å 2
HOMO Energy -11.55 ± 0.55 eV
LUMO Energy 2.65 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methylpropyl carbonochloridate
  • 2-methylpropyl chloroformate
  • 2-methylpropyl chloromethanoate
  • carbonochloridic acid, 2-methylpropyl ester
  • chlorocarbonic acid isobutyl ester
  • chloroformic acid isobutyl ester
  • formic acid, chloro-, isobutyl ester
  • formic acid, chloro-, isobutyl ester (8ci)
  • isobutyl chlorocarbonate
  • isobutyl chloroformate [na2742] [poison]
  • na2742
CAS Number(s)
  • 543-27-1
InChIKey YOETUEMZNOLGDB-UHFFFAOYSA-N
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Elements H C O Cl