Chemical Properties of m-Toluic acid, 2-(1-adamantyl)ethyl ester

m-Toluic acid, 2-(1-adamantyl)ethyl ester

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InChI
InChI=1S/C20H26O2/c1-14-3-2-4-18(7-14)19(21)22-6-5-20-11-15-8-16(12-20)10-17(9-15)13-20/h2-4,7,15-17H,5-6,8-13H2,1H3
InChI Key
QXDLZKOHACFPPP-UHFFFAOYSA-N
Formula
C20H26O2
SMILES
Cc1cccc(C(=O)OCCC23CC4CC(CC(C4)C2)C3)c1
Molecular Weight1
298.42
Other Names
  • m-toluylic acid, 2-(1-adamantyl)ethyl ester
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Physical Properties

Property Value Unit Source
Δf 143.33 kJ/mol Joback Calculated Property
Δfgas -268.73 kJ/mol Joback Calculated Property
Δfus 31.07 kJ/mol Joback Calculated Property
Δvap 70.66 kJ/mol Joback Calculated Property
log10WS -5.51 Crippen Calculated Property
logPoct/wat 4.758 Crippen Calculated Property
McVol 243.760 ml/mol McGowan Calculated Property
Pc 1812.32 kPa Joback Calculated Property
Inp [2445.70; 2445.70]   Show Hide
Inp 2445.70 NIST
Inp 2445.70 NIST
Tboil 785.01 K Joback Calculated Property
Tc 1017.93 K Joback Calculated Property
Tfus 496.22 K Joback Calculated Property
Vc 0.931 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [781.45; 901.21] J/mol×K [785.01; 1017.93] Show Hide
Cp,gas 781.45 J/mol×K 785.01 Joback Calculated Property
Cp,gas 802.52 J/mol×K 823.83 Joback Calculated Property
Cp,gas 822.82 J/mol×K 862.65 Joback Calculated Property
Cp,gas 842.60 J/mol×K 901.47 Joback Calculated Property
Cp,gas 862.09 J/mol×K 940.29 Joback Calculated Property
Cp,gas 881.54 J/mol×K 979.11 Joback Calculated Property
Cp,gas 901.21 J/mol×K 1017.93 Joback Calculated Property

Similar Compounds

p-Toluic acid, 2-(1-adamantyl)ethyl ester. o-Toluic acid, 2-(1-adamantyl)ethyl ester. m-Toluic acid, 1-adamantylmethyl ester. m-Toluic acid, 2-ethylhexyl ester. Isophthalic acid, 2-cyclohexylethyl ethyl ester. Isophthalic acid, di(2-cyclohexylethyl) ester. Isophthalic acid, 2-cyclohexylethyl isohexyl ester. Isophthalic acid, 1-adamantylmethyl octyl ester. Isophthalic acid, 1-adamantylmethyl pentyl ester. Isophthalic acid, 1-adamantylmethyl nonyl ester. Isophthalic acid, 1-adamantylmethyl heptyl ester. Isophthalic acid, 1-adamantylmethyl hexyl ester. Isophthalic acid, 1-adamantylmethyl isohexyl ester. Isophthalic acid, 2-cyclohexylethyl heptyl ester. Isophthalic acid, 2-cyclohexylethyl hexyl ester.

Find more compounds similar to m-Toluic acid, 2-(1-adamantyl)ethyl ester.

Sources

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