Chemical Properties of Glutaric acid, (2-chlorocyclohexyl)methyl 2-fluorophenyl ester

Glutaric acid, (2-chlorocyclohexyl)methyl 2-fluorophenyl ester

InChI
InChI=1S/C18H22ClFO4/c19-14-7-2-1-6-13(14)12-23-17(21)10-5-11-18(22)24-16-9-4-3-8-15(16)20/h3-4,8-9,13-14H,1-2,5-7,10-12H2
InChI Key
IVHMXXZBGHBESZ-UHFFFAOYSA-N
Formula
C18H22ClFO4
SMILES
O=C(CCCC(=O)Oc1ccccc1F)OCC1CCCCC1Cl
Molecular Weight1
356.82
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Physical Properties

Property Value Unit Source
ΔfusH° 44.95 kJ/mol Joback Calculated Property
logPoct/wat 4.242 Crippen Calculated Property
McVol 258.750 ml/mol McGowan Calculated Property
Inp [2599.00; 2599.00]   Show Hide
Inp 2599.00 NIST
Inp 2599.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [351.05; 849.69] 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-2.29460e+01
Coefficient B1.58000e+00
Coefficient C-7.92760e-04
Coefficient D8.54000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 351.05 J/mol×K 273.00 Calculated Property
Cp,gas 440.58 J/mol×K 353.78 Calculated Property
Cp,gas 520.96 J/mol×K 434.56 Calculated Property
Cp,gas 592.44 J/mol×K 515.33 Calculated Property
Cp,gas 655.29 J/mol×K 596.11 Calculated Property
Cp,gas 709.80 J/mol×K 676.89 Calculated Property
Cp,gas 756.22 J/mol×K 757.67 Calculated Property
Cp,gas 794.83 J/mol×K 838.44 Calculated Property
Cp,gas 825.90 J/mol×K 919.22 Calculated Property
Cp,gas 849.69 J/mol×K 1000.00 Calculated Property

Similar Compounds

Glutaric acid, (2-chlorocyclohexyl)methyl 2-chloro-6-fluorophenyl ester. Glutaric acid, (2-chlorocyclohexyl)methyl 3-chlorophenyl ester. Succinic acid, 2-chloro-6-fluorophenyl (2-chlorocyclohexyl)methyl ester. Succinic acid, 3-chlorophenyl (2-chlorocyclohexyl)methyl ester. Glutaric acid, 2-fluorophenyl 2-ethylhexyl ester. Glutaric acid, cyclohexylmethyl 2-fluoro-3-trifluoromethylphenyl ester. Glutaric acid, 2-ethylhexyl 2-fluoro-3-trifluoromethylphenyl ester. Glutaric acid, (cyclohex-3-enyl)methyl 2-fluorophenyl ester. Glutaric acid, 2-fluorophenyl 2-methylpentyl ester. (-)-Bunolol, PFB-TMS. Lycoramine. Ibogaine. inosine-5'-monophosphate, TMS. Retroisosenine. Naloxone, bis(trimethylsilyl) ether.

Find more compounds similar to Glutaric acid, (2-chlorocyclohexyl)methyl 2-fluorophenyl ester.

Sources

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