Chemical Properties of DIPHENYL ISOPHTHALATE

DIPHENYL ISOPHTHALATE

InChI
InChI=1S/C20H14O4/c21-19(23-17-10-3-1-4-11-17)15-8-7-9-16(14-15)20(22)24-18-12-5-2-6-13-18/h1-14H
InChI Key
FHESUNXRPBHDQM-UHFFFAOYSA-N
Formula
C20H14O4
SMILES
O=C(Oc1ccccc1)c1cccc(C(=O)Oc2ccccc2)c1
Molecular Weight1
318.33
Other Names
  • 1,3-Benzenedicarboxylic acid, diphenyl ester
  • Diphenyl m-phthalate
  • Isophthalic acid, diphenyl ester
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Physical Properties

Property Value Unit Source
ω 0.8094 Relay (1.0) Calculated Property
ΔfG° -175.62 kJ/mol Joback Calculated Property
ΔfH°gas -354.65 kJ/mol Relay (1.0) Calculated Property
ΔfH°solid -476.10 kJ/mol NIST
ΔfusH° 38.03 kJ/mol Joback Calculated Property
ΔvapH° 105.65 kJ/mol Relay (1.0) Calculated Property
IE 8.39 eV Relay (1.0) Calculated Property
log10WS -5.26 Relay (1.0) Calculated Property
logPoct/wat 4.125 Crippen Calculated Property
McVol 236.260 ml/mol McGowan Calculated Property
Pc 2163.33 kPa Joback Calculated Property
Tboil 675.33 K Relay (1.0) Calculated Property
Tc 991.36 K Relay (1.0) Calculated Property
Tfus 381.85 K Relay (1.0) Calculated Property
Vc 0.867 m3/kmol Relay (1.0) Calculated Property

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [293.21; 708.75] 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-5.18900e+01
Coefficient B1.49800e+00
Coefficient C-9.01560e-04
Coefficient D1.64200e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 293.21 J/mol×K 273.00 Calculated Property
Cp,gas 372.50 J/mol×K 353.78 Calculated Property
Cp,gas 442.30 J/mol×K 434.56 Calculated Property
Cp,gas 503.13 J/mol×K 515.33 Calculated Property
Cp,gas 555.50 J/mol×K 596.11 Calculated Property
Cp,gas 599.94 J/mol×K 676.89 Calculated Property
Cp,gas 636.96 J/mol×K 757.67 Calculated Property
Cp,gas 667.10 J/mol×K 838.44 Calculated Property
Cp,gas 690.85 J/mol×K 919.22 Calculated Property
Cp,gas 708.75 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0006091; 0.0000628] Pa×s [491.60; 779.71] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.35509e+01
Coefficient B3.02208e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.491.60
Temperature range, max.779.71
η 0.0006091 Pa×s 491.60 Calculated Property
η 0.0004183 Pa×s 523.61 Calculated Property
η 0.0003000 Pa×s 555.62 Calculated Property
η 0.0002230 Pa×s 587.64 Calculated Property
η 0.0001710 Pa×s 619.65 Calculated Property
η 0.0001346 Pa×s 651.66 Calculated Property
η 0.0001083 Pa×s 683.67 Calculated Property
η 0.0000889 Pa×s 715.68 Calculated Property
η 0.0000742 Pa×s 747.70 Calculated Property
η 0.0000628 Pa×s 779.71 Calculated Property

Similar Compounds

1,3,5-Benzenetricarboxylic acid, triphenyl ester. Benzoic acid, phenyl ester. Isophthalic acid, di(4-chlorophenyl) ester. Isophthalic acid, monochloride, phenyl ester. RESORCINOL BENZOATE. Isophthalic acid, di(3-chlorophenyl) ester. 3-Trifluoromethylbenzoic acid, phenyl ester. Diphenyl terephthalate. Isophthalic acid, di(3-fluorophenyl) ester. Benzenetricarboxylic acid, 1,2,4-, triphenyl ester. 1,4-Benzenediol, monobenzoate. Isophthalic acid, di(3-methylphenyl) ester. Isophthalic acid, di(3,5-dichlorophenyl) ester. 1,3-Benzenediol, monobenzoate. Isophthalic acid, ethyl phenyl ester.

Find more compounds similar to DIPHENYL ISOPHTHALATE.

Sources

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