2-Oxocanone

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Properties Simple | Detailed

Formula C7H12O2
IUPAC Name oxocan-2-one
Molecular Mass 128.169 g·mol−1
Heat of Formation -396.2 ± 16.7 kJ·mol−1
Dipole Moment 4.93 ± 1.08 D
Volume 163.19 Å 3
Surface Area 158.81 Å 2
HOMO Energy -10.34 ± 0.55 eV
LUMO Energy 4.22 ± eV
Point Group Symmetry C1
CAS Number(s)
  • 539-87-7
InChIKey BTLSLHNLDQCWKS-UHFFFAOYSA-N
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