Chemical Properties of «alpha»-Hydroxypentacosanoic acid, HFB-Me

«alpha»-Hydroxypentacosanoic acid, HFB-Me

InChI
InChI=1S/C30H51F7O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25(26(38)40-2)41-27(39)28(31,32)29(33,34)30(35,36)37/h25H,3-24H2,1-2H3
InChI Key
OUIDBWRLESQWIS-UHFFFAOYSA-N
Formula
C30H51F7O4
SMILES
CCCCCCCCCCCCCCCCCCCCCCCC(OC(=O)C(F)(F)C(F)(F)C(F)(F)F)C(=O)OC
Molecular Weight1
608.71
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Physical Properties

Property Value Unit Source
ΔfusH° 77.99 kJ/mol Joback Calculated Property
logPoct/wat 10.506 Crippen Calculated Property
McVol 460.830 ml/mol McGowan Calculated Property
Inp 2849.00 NIST
Tboil 651.16 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [727.27; 1637.71] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-6.02800e+00
Coefficient B3.21014e+00
Coefficient C-2.05240e-03
Coefficient D4.86000e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 727.27 J/mol×K 273.00 Calculated Property
Cp,gas 894.29 J/mol×K 353.78 Calculated Property
Cp,gas 1041.27 J/mol×K 434.56 Calculated Property
Cp,gas 1169.72 J/mol×K 515.33 Calculated Property
Cp,gas 1281.20 J/mol×K 596.11 Calculated Property
Cp,gas 1377.24 J/mol×K 676.89 Calculated Property
Cp,gas 1459.37 J/mol×K 757.67 Calculated Property
Cp,gas 1529.14 J/mol×K 838.44 Calculated Property
Cp,gas 1588.07 J/mol×K 919.22 Calculated Property
Cp,gas 1637.71 J/mol×K 1000.00 Calculated Property

Similar Compounds

«alpha»-Hydroxyarachidic acid, HFB-Me. «alpha»-Hydroxylignoceric acid, HFB-Me. .alpha.-Hydroxybehenic acid, HFB-Me. «alpha»-Hydroxycerotic acid, HFB-Me. «alpha»-Hydroxytricosanoic acid, HFB-Me. «alpha»-Hydroxystearic acid, HFB-Me. .alpha.-Hydroxynervonic acid, HFB-Me. (+-)-2-Hydroxyoctanoic acid, pentafluoropropionate. 2-Hydroxyisocaproic acid, heptafluorobutyrate. (+-)-2-Hydroxyoctanoic acid, trifluoroacetate. Pentadecafluorooctanoic acid, dec-2-yl ester. Glutaric acid, 1-(cyclohex-2-enyl)hex-3-yl 2,2,3,3,4,4,5,5-octafluoropentyl ester. 2-Hydroxyisocaproic acid, pentafluoropropionate. Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2-octyl ester. Glutaric acid, 2,2,3,3,4,4,5,5-octafluoropentyl 2-decyl ester.

Find more compounds similar to «alpha»-Hydroxypentacosanoic acid, HFB-Me.

Sources

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