Chemical Properties of (+-)-3-hydroxybutyric acid, heptafluorobutyrate

(+-)-3-hydroxybutyric acid, heptafluorobutyrate

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InChI
InChI=1S/C8H7F7O4/c1-3(2-4(16)17)19-5(18)6(9,10)7(11,12)8(13,14)15/h3H,2H2,1H3,(H,16,17)
InChI Key
BTCLXOUNCZJBIF-UHFFFAOYSA-N
Formula
C8H7F7O4
SMILES
CC(CC(=O)O)OC(=O)C(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
300.13
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Physical Properties

Property Value Unit Source
Δf -1840.77 kJ/mol Joback Calculated Property
Δfgas -2122.36 kJ/mol Joback Calculated Property
Δfus 20.75 kJ/mol Joback Calculated Property
Δvap 55.99 kJ/mol Joback Calculated Property
log10WS -2.54 Crippen Calculated Property
logPoct/wat 2.226 Crippen Calculated Property
McVol 150.850 ml/mol McGowan Calculated Property
Pc 2414.74 kPa Joback Calculated Property
Inp [1063.00; 1063.00]   Show Hide
Inp 1063.00 NIST
Inp 1063.00 NIST
Tboil 589.54 K Joback Calculated Property
Tc 747.72 K Joback Calculated Property
Tfus 359.22 K Joback Calculated Property
Vc 0.620 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [417.70; 461.38] J/mol×K [589.54; 747.72] Show Hide
Cp,gas 417.70 J/mol×K 589.54 Joback Calculated Property
Cp,gas 426.33 J/mol×K 615.90 Joback Calculated Property
Cp,gas 434.38 J/mol×K 642.27 Joback Calculated Property
Cp,gas 441.88 J/mol×K 668.63 Joback Calculated Property
Cp,gas 448.86 J/mol×K 694.99 Joback Calculated Property
Cp,gas 455.35 J/mol×K 721.36 Joback Calculated Property
Cp,gas 461.38 J/mol×K 747.72 Joback Calculated Property

Similar Compounds

(+-)-3-hydroxybutyric acid, pentafluoropropionate. (+-)-3-hydroxybutyric acid, trifluoroacetate. Heptafluorobutyric acid, 2-pentyl ester. (S)-(-)-1,2,4-Butanetriol, 2,4-di(heptafluorobutyrate). 3-Hexanol, heptafluorobutyrate. (+-)-3-hydroxybutyric acid, acetate. Pentadecafluorooctanoic acid, pent-2-yl ester. 2-Octanol, heptafluorobutyrate. 2-Decanol, heptafluorobutyrate. Pentadecafluorooctanoic acid, 3-methylbut-2-yl ester. 3-Heptanol, heptafluorobutyrate. 2-Hydroxyisocaproic acid, heptafluorobutyrate. (S)-(-)-1,2,4-Butanetriol, 4-heptafluorobutyrate. Pentadecafluorooctanoic acid, dec-2-yl ester. Pentadecafluorooctanoic acid, 4-methyl-2-pentyl ester.

Find more compounds similar to (+-)-3-hydroxybutyric acid, heptafluorobutyrate.

Sources

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