Simfibrate

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Properties Simple | Detailed

Formula C23H26Cl2O6
IUPAC Name 3-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxypropyl 2-(4-chlorophenoxy)-2-methyl-propanoate
Molecular Mass 469.355 g·mol−1
Heat of Formation -1056.6 ± 16.7 kJ·mol−1
Dipole Moment 4.50 ± 1.08 D
Volume 542.88 Å 3
Surface Area 397.41 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy -0.29 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3-propanediol bis(2-(4-chlorophenoxy)-2-methylpropionate)
  • 1,3-propanediol bis(alpha-(p-chlorophenoxy)isobutyrate)
  • 2-(4-chlorophenoxy)-2-methyl-propionic acid 3-[2-(4-chlorophenoxy)-2-methyl-propanoyl]oxypropyl ester
  • 2-(4-chlorophenoxy)-2-methylpropanoic acid 1,3-propanediyl ester
  • 2-(4-chlorophenoxy)-2-methylpropanoic acid 3-[2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy]propyl ester
  • 2-(p-chlorophenoxy)-2-methylpropionic acid trimethylene ester
  • 3-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxypropyl 2-(4-chlorophenoxy)-2-methylpropanoate
  • cholesolvin
  • cly-503
  • d01212
  • propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,3-propanediyl ester
  • simfibrate (jan)
  • sinfibrate
CAS Number(s)
  • 14929-11-4
InChIKey JLRNKCZRCMIVKA-UHFFFAOYSA-N
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Elements H C O Cl