3-Methyl-2-Pentenedioic Acid Ethyl Ester

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Properties Simple | Detailed

Formula C8H12O4
IUPAC Name (e)-5-ethoxy-3-methyl-5-oxo-pent-3-enoic acid
Molecular Mass 172.178 g·mol−1
Heat of Formation -774.5 ± 16.7 kJ·mol−1
Dipole Moment 2.58 ± 1.08 D
Volume 211.28 Å 3
Surface Area 213.02 Å 2
HOMO Energy -10.46 ± 0.55 eV
LUMO Energy 2.74 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-5-ethoxy-3-methyl-5-oxo-pent-3-enoic acid
  • (e)-5-ethoxy-3-methyl-5-oxopent-3-enoic acid
  • (e)-5-ethoxy-5-keto-3-methyl-pent-3-enoic acid
InChIKey BJIMLCFDYWLLMP-AATRIKPKSA-N
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Elements H C O