Cas no 61284-40-0 (5-Heptenoic acid,7-[2-(4-carboxy-3-hydroxy-3-methyl-1-butenyl)-3,5-dihydroxycyclopentyl]-)

5-Heptenoic acid,7-[2-(4-carboxy-3-hydroxy-3-methyl-1-butenyl)-3,5-dihydroxycyclopentyl]- structure
61284-40-0 structure
Product Name:5-Heptenoic acid,7-[2-(4-carboxy-3-hydroxy-3-methyl-1-butenyl)-3,5-dihydroxycyclopentyl]-
CAS No:61284-40-0
MF:C18H28O7
MW:356.410726547241
CID:485924
Update Time:2024-01-30

5-Heptenoic acid,7-[2-(4-carboxy-3-hydroxy-3-methyl-1-butenyl)-3,5-dihydroxycyclopentyl]- Chemical and Physical Properties

Names and Identifiers

    • 5-Heptenoic acid,7-[2-(4-carboxy-3-hydroxy-3-methyl-1-butenyl)-3,5-dihydroxycyclopentyl]-
    • 5-Heptenoic acid, 7-[2-(4-carboxy-3-hydroxy-3-methyl-1-buten-1-yl)-3,5-dihydroxycyclopentyl]-
    • Inchi: 1S/C18H28O7/c1-18(25,11-17(23)24)9-8-13-12(14(19)10-15(13)20)6-4-2-3-5-7-16(21)22/h2,4,8-9,12-15,19-20,25H,3,5-7,10-11H2,1H3,(H,21,22)(H,23,24)
    • InChI Key: ZCUUWJCCXNTDRX-UHFFFAOYSA-N
    • SMILES: C(O)(=O)CCCC=CCC1C(O)CC(O)C1C=CC(O)(C)CC(O)=O

Computed Properties

  • Exact Mass: 356.18354

Experimental Properties

  • Density: 1.326±0.06 g/cm3(Predicted)
  • Boiling Point: 597.2±50.0 °C(Predicted)
  • PSA: 135.29
  • pka: 4.24±0.10(Predicted)
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