Chemical Properties of Glutaric acid, hex-4-yn-3-yl 2-chloro-6-fluorophenyl ester

Glutaric acid, hex-4-yn-3-yl 2-chloro-6-fluorophenyl ester

InChI
InChI=1S/C17H18ClFO4/c1-3-7-12(4-2)22-15(20)10-6-11-16(21)23-17-13(18)8-5-9-14(17)19/h5,8-9,12H,4,6,10-11H2,1-2H3
InChI Key
INTXJVAMMLJPOG-UHFFFAOYSA-N
Formula
C17H18ClFO4
SMILES
CC#CC(CC)OC(=O)CCCC(=O)Oc1c(F)cccc1Cl
Molecular Weight1
340.77
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Physical Properties

Property Value Unit Source
ΔfusH° 48.66 kJ/mol Joback Calculated Property
logPoct/wat 3.900 Crippen Calculated Property
McVol 246.920 ml/mol McGowan Calculated Property
Inp [2240.00; 2240.00]   Show Hide
Inp 2240.00 NIST
Inp 2240.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [351.03; 742.74] 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 A6.78040e+01
Coefficient B1.18604e+00
Coefficient C-5.56780e-04
Coefficient D4.56800e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 351.03 J/mol×K 273.00 Calculated Property
Cp,gas 419.74 J/mol×K 353.78 Calculated Property
Cp,gas 481.81 J/mol×K 434.56 Calculated Property
Cp,gas 537.40 J/mol×K 515.33 Calculated Property
Cp,gas 586.64 J/mol×K 596.11 Calculated Property
Cp,gas 629.68 J/mol×K 676.89 Calculated Property
Cp,gas 666.67 J/mol×K 757.67 Calculated Property
Cp,gas 697.75 J/mol×K 838.44 Calculated Property
Cp,gas 723.06 J/mol×K 919.22 Calculated Property
Cp,gas 742.74 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, 2-chloro-6-fluorophenyl non-5-yn-3-yl ester. Glutaric acid, hex-4-yn-3-yl 2,6-dichlorophenyl ester. Glutaric acid, but-3-yn-2-yl 2-chloro-6-fluorophenyl ester. Glutaric acid, hex-4-yn-3-yl 2,4-dichlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-pentyl ester. Glutaric acid, hex-4-yn-3-yl 2,3-dichlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 3-hexyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 3-octyl ester. Glutaric acid, hex-4-yn-3-yl 2,5-dichlorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-hexyl ester. Glutaric acid, 3-methylbut-2-yl 2-chloro-6-fluorophenyl ester. Glutaric acid, 2-chloro-6-fluorophenyl hept-4-yl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-octyl ester. Glutaric acid, 2-chloro-6-fluorophenyl 2-decyl ester. Glutaric acid, hex-4-yn-3-yl 2-chloro-5-methylphenyl ester.

Find more compounds similar to Glutaric acid, hex-4-yn-3-yl 2-chloro-6-fluorophenyl ester.

Sources

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