Methyl {(1S,2S)-3-Oxo-2-[(2E)-2-Penten-1-Yl]Cyclopentyl}Acetate

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Properties Simple | Detailed

Formula C13H20O3
IUPAC Name methyl 2-[(1s,2s)-3-oxo-2-[(e)-pent-2-enyl]cyclopentyl]acetate
Molecular Mass 224.296 g·mol−1
Heat of Formation -615.6 ± 16.7 kJ·mol−1
Dipole Moment 1.62 ± 1.08 D
Volume 299.03 Å 3
Surface Area 255.09 Å 2
HOMO Energy -9.76 ± 0.55 eV
LUMO Energy 3.78 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(1s,2s)-3-keto-2-[(e)-pent-2-enyl]cyclopentyl]acetic acid methyl ester
  • 2-[(1s,2s)-3-oxo-2-[(e)-pent-2-enyl]cyclopentyl]acetic acid methyl ester
  • cyclopentaneacetic acid, 3-oxo-2-(2z)-2-pentenyl-, methyl ester, (1r,2s)-rel-
  • methyl (z)-(cis)-3-oxo-2-(2-pentenyl)cyclopentaneacetate
  • methyl 2-[(1s,2s)-3-oxo-2-[(e)-pent-2-enyl]cyclopentyl]acetate
  • methyl 2-[(1s,2s)-3-oxo-2-[(e)-pent-2-enyl]cyclopentyl]ethanoate
CAS Number(s)
  • 42536-97-0
  • 53369-26-9
InChIKey GEWDNTWNSAZUDX-NNOMMRTBSA-N
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