Chemical Properties of Doconexent (CAS 6217-54-5)

Doconexent

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InChI
InChI=1S/C22H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24/h3-4,6-7,9-10,12-13,15-16,18-19H,2,5,8,11,14,17,20-21H2,1H3,(H,23,24)/b4-3-,7-6-,10-9-,13-12-,16-15-,19-18-
InChI Key
MBMBGCFOFBJSGT-KUBAVDMBSA-N
Formula
C22H32O2
SMILES
CCC=CCC=CCC=CCC=CCC=CCC=CCCC(=O)O
Molecular Weight1
328.49
CAS
6217-54-5
Other Names
  • (all-Z)-4,7,10,13,16,19-Docosahexaenoic acid
  • 4,7,10,13,16,19-Docosahexaenoic acid
  • 4,7,10,13,16,19-Docosahexaenoic acid, (4Z,7Z,10Z,13Z,16Z,19Z)-
  • 4,7,10,13,16,19-Docosahexaenoic acid, (all cis)-
  • 4-cis,7-cis,10-cis,13-cis,16-cis,19-cis-Docosahexaenoic acid
  • AquaGrow Advantage
  • Cervonic acid
  • DHA
  • Docosahexaenoic acid
  • Martek DHA HM
  • Ropufa 60
  • cis-4,7,10,13,16,19-Docosahexaenoic acid
  • cis-4,7,10,13,16,19-Docosahexanoic acid

Physical Properties

Property Value Unit Source
Δf 349.94 kJ/mol Joback Calculated Property
Δfgas -58.90 kJ/mol Joback Calculated Property
Δfus 59.63 kJ/mol Joback Calculated Property
Δvap 87.74 kJ/mol Joback Calculated Property
log10WS -7.25 Crippen Calculated Property
logPoct/wat 6.549 Crippen Calculated Property
McVol 302.480 ml/mol McGowan Calculated Property
Pc 1219.99 kPa Joback Calculated Property
Inp [2520.90; 2520.90]   Show Hide
Inp 2520.90 NIST
Inp 2520.90 NIST
Tboil 873.77 K Joback Calculated Property
Tc 1073.06 K Joback Calculated Property
Tfus 417.97 K Joback Calculated Property
Vc 1.173 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [919.10; 1011.34] J/mol×K [873.77; 1073.06] Show Hide
Cp,gas 919.10 J/mol×K 873.77 Joback Calculated Property
Cp,gas 935.35 J/mol×K 906.99 Joback Calculated Property
Cp,gas 951.09 J/mol×K 940.20 Joback Calculated Property
Cp,gas 966.44 J/mol×K 973.42 Joback Calculated Property
Cp,gas 981.52 J/mol×K 1006.63 Joback Calculated Property
Cp,gas 996.45 J/mol×K 1039.85 Joback Calculated Property
Cp,gas 1011.34 J/mol×K 1073.06 Joback Calculated Property
η [0.0000049; 0.0009411] Pa×s [417.97; 873.77] Show Hide
η 0.0009411 Pa×s 417.97 Joback Calculated Property
η 0.0002003 Pa×s 493.94 Joback Calculated Property
η 0.0000644 Pa×s 569.90 Joback Calculated Property
η 0.0000270 Pa×s 645.87 Joback Calculated Property
η 0.0000136 Pa×s 721.84 Joback Calculated Property
η 0.0000078 Pa×s 797.80 Joback Calculated Property
η 0.0000049 Pa×s 873.77 Joback Calculated Property
ΔvapH 162.90 ± 2.30 kJ/mol 298.15 Vaporiz...
Pvap 2.20e-11 ± 1.65e-11 kPa 298.15 Vaporiz...

Similar Compounds

4-Hexenoic acid. 4,7,10,13,16,19-Docosahexaenoic acid, methyl ester. 4,7,10,13,16,19-Docosahexaenoic acid, methyl ester, (all-Z)-. cis-5,8,11,14,17-Eicosapentaenoic acid. 4-Heptenoic acid, methyl ester. cis-4,7,10,13,16,19-Docosahexaenoic acid, trimethylsilyl ester. ethyl 4,7-octadienoate. Arachidonic acid. 9,12,15-Octadecatrienoic acid, (Z,Z,Z)-. 7,10,13-Hexadecatrienoic acid. 9,12,15-Octadecatrienoic acid. (E)-4, (Z)-7-decadienol-1. Gamolenic acid. Methyl 4,8-decadienoate. Linoelaidic acid.

Find more compounds similar to Doconexent.

Sources

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