1-Bromoacetone

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Properties Simple | Detailed

Formula C3H5BrO
IUPAC Name 1-bromopropan-2-one
Molecular Mass 136.975 g·mol−1
Heat of Formation -193.1 ± 16.7 kJ·mol−1
Dipole Moment 4.22 ± 1.08 D
Volume 112.56 Å 3
Surface Area 125.55 Å 2
HOMO Energy -10.20 ± 0.55 eV
LUMO Energy 3.28 ± eV
Point Group Symmetry Cs
Synonyms
  • .alpha.-bromoacetone
  • 1-bromo-2-propanone
  • 2-propanone, 1-bromo-
  • 2-propanone, 1-bromo- (9ci)
  • 2-propanone, bromo-
  • acetonyl bromide
  • acetyl methyl bromide
  • acetylmethyl bromide
  • b-stoff
  • ba (tear gas)
  • bromo-2-propanone
  • bromoacetone
  • bromoacetone [un1569] [poison]
  • bromomethyl methyl ketone
  • martonite
  • monobromoacetone
CAS Number(s)
  • 598-31-2
InChIKey VQFAIAKCILWQPZ-UHFFFAOYSA-N
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Elements H C O Br