Diethyl Fumarate

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Properties Simple | Detailed

Formula C8H12O4
IUPAC Name diethyl (e)-but-2-enedioate
Molecular Mass 172.178 g·mol−1
Heat of Formation -700.3 ± 16.7 kJ·mol−1
Dipole Moment 0.01 ± 1.08 D
Volume 210.24 Å 3
Surface Area 221.72 Å 2
HOMO Energy -10.99 ± 0.55 eV
LUMO Energy 1.95 ± eV
Point Group Symmetry C2h
Synonyms
  • (e)-but-2-enedioic acid diethyl ester
  • 2-butenedioic acid (2e)-, diethyl ester
  • 2-butenedioic acid (e)-, diethyl ester
  • 2-butenedioic acid (e)-, diethyl ester (9ci)
  • 2-butenedioic acid, diethyl ester, (2e)-
  • 2-butenedioic acid, diethyl ester, (e)-
  • anti-psoriaticum
  • but-2-enedioic acid diethyl ester
  • diethyl (2e)-but-2-enedioate
  • diethyl (e)-but-2-enedioate
  • diethyl but-2-enedioate
  • ethyl fumarate
  • fumaric acid, diethyl ester
  • fumaric acid, diethyl ester (8ci)
  • trans-2-butenedioic acid diethyl ester
CAS Number(s)
  • 623-91-6
InChIKey IEPRKVQEAMIZSS-AATRIKPKSA-N
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