Chemical Properties of Benzoic acid, isohexyl ester

Benzoic acid, isohexyl ester

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InChI
InChI=1S/C13H18O2/c1-11(2)7-6-10-15-13(14)12-8-4-3-5-9-12/h3-5,8-9,11H,6-7,10H2,1-2H3
InChI Key
UUNAMHRNRUJYDO-UHFFFAOYSA-N
Formula
C13H18O2
SMILES
CC(C)CCCOC(=O)c1ccccc1
Molecular Weight1
206.28
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Physical Properties

Property Value Unit Source
Δf -65.37 kJ/mol Joback Calculated Property
Δfgas -325.20 kJ/mol Joback Calculated Property
Δfus 22.73 kJ/mol Joback Calculated Property
Δvap 55.58 kJ/mol Joback Calculated Property
log10WS -3.57 Crippen Calculated Property
logPoct/wat 3.280 Crippen Calculated Property
McVol 177.710 ml/mol McGowan Calculated Property
Pc 2309.17 kPa Joback Calculated Property
Inp [1592.00; 1592.00]   Show Hide
Inp 1592.00 NIST
Inp 1592.00 NIST
Tboil 599.37 K Joback Calculated Property
Tc 806.35 K Joback Calculated Property
Tfus 319.85 K Joback Calculated Property
Vc 0.673 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [443.71; 527.37] J/mol×K [599.37; 806.35] Show Hide
Cp,gas 443.71 J/mol×K 599.37 Joback Calculated Property
Cp,gas 459.89 J/mol×K 633.87 Joback Calculated Property
Cp,gas 475.13 J/mol×K 668.36 Joback Calculated Property
Cp,gas 489.48 J/mol×K 702.86 Joback Calculated Property
Cp,gas 502.95 J/mol×K 737.36 Joback Calculated Property
Cp,gas 515.57 J/mol×K 771.85 Joback Calculated Property
Cp,gas 527.37 J/mol×K 806.35 Joback Calculated Property
η [0.0001567; 0.0027865] Pa×s [319.85; 599.37] Show Hide
η 0.0027865 Pa×s 319.85 Joback Calculated Property
η 0.0012714 Pa×s 366.44 Joback Calculated Property
η 0.0006925 Pa×s 413.02 Joback Calculated Property
η 0.0004266 Pa×s 459.61 Joback Calculated Property
η 0.0002873 Pa×s 506.20 Joback Calculated Property
η 0.0002068 Pa×s 552.78 Joback Calculated Property
η 0.0001567 Pa×s 599.37 Joback Calculated Property

Similar Compounds

Isophthalic acid, isohexyl 3-methylbutyl ester. Terephthalic acid, isohexyl 3-methylbutyl ester. Benzoic acid, pentyl ester. Benzoic acid, hexyl ester. Isophthalic acid, isohexyl neopentyl ester. Isophthalic acid, 3-methylbutyl pentyl ester. Benzoic acid, heptyl ester. Benzoic acid, undecyl ester. Benzoic acid, nonadecyl ester. Benzoic acid, pentadecyl ester. nonyl benzoate. Behenyl benzoate. decyl benzoate. dodecyl benzoate. Benzoic acid, eicosyl ester.

Find more compounds similar to Benzoic acid, isohexyl ester.

Sources

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