Isopropyl (2E)-But-2-Enoate

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Properties Simple | Detailed

Formula C7H12O2
IUPAC Name isopropyl (e)-but-2-enoate
Molecular Mass 128.169 g·mol−1
Heat of Formation -409.3 ± 16.7 kJ·mol−1
Dipole Moment 2.06 ± 1.08 D
Volume 174.12 Å 3
Surface Area 183.63 Å 2
HOMO Energy -10.54 ± 0.55 eV
LUMO Energy 3.00 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-but-2-enoic acid isopropyl ester
  • 1-methylethyl (2e)-2-butenoate
  • 2-butenoic acid, 1-methylethyl ester
  • 2-butenoic acid, 1-methylethyl ester, (2e)-
  • but-2-enoic acid isopropyl ester
  • isopropyl (e)-but-2-enoate
  • isopropyl but-2-enoate
  • propan-2-yl (e)-but-2-enoate
  • propan-2-yl but-2-enoate
CAS Number(s)
  • 18060-77-0
  • 6284-46-4
InChIKey AABBHSMFGKYLKE-SNAWJCMRSA-N
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