Chemical Properties of Isophthalic acid, isobutyl 3-phenylpropyl ester

Isophthalic acid, isobutyl 3-phenylpropyl ester

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InChI
InChI=1S/C21H24O4/c1-16(2)15-25-21(23)19-12-6-11-18(14-19)20(22)24-13-7-10-17-8-4-3-5-9-17/h3-6,8-9,11-12,14,16H,7,10,13,15H2,1-2H3
InChI Key
XLLNTTQYUFZBFX-UHFFFAOYSA-N
Formula
C21H24O4
SMILES
CC(C)COC(=O)c1cccc(C(=O)OCCCc2ccccc2)c1
Molecular Weight1
340.41
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Physical Properties

Property Value Unit Source
Δf -129.15 kJ/mol Joback Calculated Property
Δfgas -510.06 kJ/mol Joback Calculated Property
Δfus 39.89 kJ/mol Joback Calculated Property
Δvap 85.48 kJ/mol Joback Calculated Property
log10WS -5.42 Crippen Calculated Property
logPoct/wat 4.289 Crippen Calculated Property
McVol 274.110 ml/mol McGowan Calculated Property
Pc 1616.77 kPa Joback Calculated Property
Inp [2742.00; 2742.00]   Show Hide
Inp 2742.00 NIST
Inp 2742.00 NIST
Tboil 890.36 K Joback Calculated Property
Tc 1115.31 K Joback Calculated Property
Tfus 521.11 K Joback Calculated Property
Vc 1.038 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [839.84; 907.00] J/mol×K [890.36; 1115.31] Show Hide
Cp,gas 839.84 J/mol×K 890.36 Joback Calculated Property
Cp,gas 854.24 J/mol×K 927.85 Joback Calculated Property
Cp,gas 867.30 J/mol×K 965.34 Joback Calculated Property
Cp,gas 879.07 J/mol×K 1002.83 Joback Calculated Property
Cp,gas 889.58 J/mol×K 1040.32 Joback Calculated Property
Cp,gas 898.87 J/mol×K 1077.81 Joback Calculated Property
Cp,gas 907.00 J/mol×K 1115.31 Joback Calculated Property
η [0.0000447; 0.0005174] Pa×s [521.11; 890.36] Show Hide
η 0.0005174 Pa×s 521.11 Joback Calculated Property
η 0.0002773 Pa×s 582.65 Joback Calculated Property
η 0.0001674 Pa×s 644.19 Joback Calculated Property
η 0.0001104 Pa×s 705.73 Joback Calculated Property
η 0.0000778 Pa×s 767.28 Joback Calculated Property
η 0.0000577 Pa×s 828.82 Joback Calculated Property
η 0.0000447 Pa×s 890.36 Joback Calculated Property

Similar Compounds

Isophthalic acid, 3-phenylpropyl propyl ester. Isophthalic acid, ethyl 3-phenylpropyl ester. Isophthalic acid, butyl 3-phenylpropyl ester. Isophthalic acid, pentyl 3-phenylpropyl ester. Isophthalic acid, decyl 3-phenylpropyl ester. Isophthalic acid, nonyl 3-phenylpropyl ester. Isophthalic acid, octyl 3-phenylpropyl ester. 4-Butylbenzoic acid, 4-methoxy-2-methylbutyl ester. Nicotinic acid, 3-phenylpropyl ester. Isonicotinic acid, 3-phenylpropyl ester. Isophthalic acid, isobutyl 1-phenylpropyl ester. Isophthalic acid, isobutyl phenylethyl ester. 4-Butylbenzoic acid, 3-methylbutyl ester. 4-Butylbenzoic acid, hexyl ester. 4-Butylbenzoic acid, pentyl ester.

Find more compounds similar to Isophthalic acid, isobutyl 3-phenylpropyl ester.

Sources

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