{[(2S)-6,7-Dichloro-2-Cyclopentyl-2-Methyl-1-Oxo-2,3-Dihydro-1H-Inden-5-Yl]Oxy}Acetic Acid

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Properties Simple | Detailed

Formula C17H18Cl2O4
IUPAC Name 2-[(2s)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-indan-5-yl]oxyacetic acid
Molecular Mass 357.228 g·mol−1
Heat of Formation -738.3 ± 16.7 kJ·mol−1
Dipole Moment 7.05 ± 1.08 D
Volume 392.39 Å 3
Surface Area 334.67 Å 2
HOMO Energy -9.49 ± 0.55 eV
LUMO Energy -0.85 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(2s)-6,7-dichloro-2-cyclopentyl-1-keto-2-methyl-indan-5-yl]oxyacetic acid
  • 2-[(2s)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-indan-5-yl]oxyacetic acid
  • 2-[[(2s)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-3h-inden-5-yl]oxy]ethanoic acid
  • 2-[[(2s)-6,7-dichloro-2-cyclopentyl-2-methyl-1-oxo-5-indanyl]oxy]acetic acid
  • bio1_000080
  • bio1_000569
  • bio1_001058
  • bio2_000075
  • bio2_000555
  • cbiol_001794
  • iaa-94
  • indanyloxyacetic acid
CAS Number(s)
  • 54197-31-8
InChIKey RNOJGTHBMJBOSP-KRWDZBQOSA-N
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Elements H C O Cl