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Home> Encyclopedia > Hot Product Listed 1   > 15-hydroxy-5,8,11,13-eicosatetraenoic acid
367501-08-4 structure

15-hydroxy-5,8,11,13-eicosatetraenoic acid

Iupac Name:4-(2,4-difluorophenoxy)piperidine
CAS No.:367501-08-4
Molecular Weight:213.228
Molecular Formula:C21H26N4 (isomer)
Names and Identifiers
Synonyms

5,8,11,13-Eicosatetraenoic acid, 15-hydroxy-

Inchi
InChI=1S/C11H13F2NO/c12-8-1-2-11(10(13)7-8)15-9-3-5-14-6-4-9/h1-2,7,9,14H,3-6H2
InChkey
LJTKODIQFDAGSL-UHFFFAOYSA-N
Canonical Smiles
C1CNCCC1OC2=C(C=C(C=C2)F)F
Properties
Density
1.334
Boiling Point
333.6 °C at 760 mmHg
Flash Point
331.9°C
Computational chemical data
  • Molecular Weight:213.228g/mol
  • Molecular Formula:C21H26N4
  • Compound Is Canonicalized:True
  • Exact Mass:213.097
  • Monoisotopic Mass:213.097
  • Complexity:197
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:21.3A^2
  • Heavy Atom Count:15
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccByIYAAAAAAAAAAAAAAAAAAAAAAAAA8QAAAAAAAAAABAAAAHwAQAAAACBThkA4wBoLABACA ACBCAAACCAAgIAAIiIAOCIgMJiKEsRqGOCCm0BGIqAeQQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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