Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, isohexyl 4-methoxyphenyl ester

1,2-Cyclohexanedicarboxylic acid, isohexyl 4-methoxyphenyl ester

InChI
InChI=1S/C21H30O5/c1-15(2)7-6-14-25-20(22)18-8-4-5-9-19(18)21(23)26-17-12-10-16(24-3)11-13-17/h10-13,15,18-19H,4-9,14H2,1-3H3
InChI Key
XGFOFQIRAQSMNY-UHFFFAOYSA-N
Formula
C21H30O5
SMILES
COc1ccc(OC(=O)C2CCCCC2C(=O)OCCCC(C)C)cc1
Molecular Weight1
362.46
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Physical Properties

Property Value Unit Source
ΔfusH° 43.11 kJ/mol Joback Calculated Property
logPoct/wat 4.386 Crippen Calculated Property
McVol 292.880 ml/mol McGowan Calculated Property
Inp [2656.00; 2656.00]   Show Hide
Inp 2656.00 NIST
Inp 2656.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [408.18; 1008.16] 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-2.08370e+01
Coefficient B1.78916e+00
Coefficient C-8.11360e-04
Coefficient D5.12000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 408.18 J/mol×K 273.00 Calculated Property
Cp,gas 512.85 J/mol×K 353.78 Calculated Property
Cp,gas 607.64 J/mol×K 434.56 Calculated Property
Cp,gas 692.71 J/mol×K 515.33 Calculated Property
Cp,gas 768.23 J/mol×K 596.11 Calculated Property
Cp,gas 834.36 J/mol×K 676.89 Calculated Property
Cp,gas 891.25 J/mol×K 757.67 Calculated Property
Cp,gas 939.08 J/mol×K 838.44 Calculated Property
Cp,gas 977.99 J/mol×K 919.22 Calculated Property
Cp,gas 1008.16 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0007728; 0.0000560] Pa×s [460.40; 756.58] 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-1.38681e+01
Coefficient B3.08589e+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.460.40
Temperature range, max.756.58
η 0.0007728 Pa×s 460.40 Calculated Property
η 0.0004942 Pa×s 493.31 Calculated Property
η 0.0003342 Pa×s 526.22 Calculated Property
η 0.0002366 Pa×s 559.13 Calculated Property
η 0.0001741 Pa×s 592.04 Calculated Property
η 0.0001323 Pa×s 624.95 Calculated Property
η 0.0001034 Pa×s 657.86 Calculated Property
η 0.0000827 Pa×s 690.76 Calculated Property
η 0.0000675 Pa×s 723.67 Calculated Property
η 0.0000560 Pa×s 756.58 Calculated Property

Similar Compounds

1,2-Cyclohexanedicarboxylic acid, dodecyl 4-methoxyphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 4-methoxyphenyl octyl ester. 1,2-Cyclohexanedicarboxylic acid, 4-methoxyphenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, heptyl 4-methoxyphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 4-methoxyphenyl nonyl ester. 1,2-Cyclohexanedicarboxylic acid, hexyl 4-methoxyphenyl ester. 1,2-Cyclohexanedicarboxylic acid, decyl 4-methoxyphenyl ester. 1,2-Cyclohexanedicarboxylic acid, 4-methoxyphenyl propyl ester. 1,2-Cyclohexanedicarboxylic acid, isobutyl 4-methoxyphenyl ester. 1,2-Cyclohexanedicarboxylic acid, undecyl 4-isopropyloxyphenyl diester. 1,2-Cyclohexanedicarboxylic acid, nonyl 4-isopropyloxyphenyl dieste. 1,2-Cyclohexanedicarboxylic acid, 4-bromophenyl isohexyl ester. 1,2-Cyclohexanedicarboxylic acid, 4-chlorophenyl pentyl ester. 1,2-Cyclohexanedicarboxylic acid, 4-bromophenyl octyl ester. 1,2-Cyclohexanedicarboxylic acid, 4-bromophenyl decyl ester.

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, isohexyl 4-methoxyphenyl ester.

Sources

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