Chemical Properties of Diglycolic acid, 2-bromo-4-fluorophenyl heptyl ester

Diglycolic acid, 2-bromo-4-fluorophenyl heptyl ester

InChI
InChI=1S/C17H22BrFO5/c1-2-3-4-5-6-9-23-16(20)11-22-12-17(21)24-15-8-7-13(19)10-14(15)18/h7-8,10H,2-6,9,11-12H2,1H3
InChI Key
KIRPFSPZTADQAC-UHFFFAOYSA-N
Formula
C17H22BrFO5
SMILES
CCCCCCCOC(=O)COCC(=O)Oc1ccc(F)cc1Br
Molecular Weight1
405.26
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Physical Properties

Property Value Unit Source
ΔfusH° 51.34 kJ/mol Joback Calculated Property
logPoct/wat 4.024 Crippen Calculated Property
McVol 266.650 ml/mol McGowan Calculated Property
Inp [3203.00; 3203.00]   Show Hide
Inp 3203.00 NIST
Inp 3203.00 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [384.22; 822.63] 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 A7.27280e+01
Coefficient B1.29812e+00
Coefficient C-5.85720e-04
Coefficient D3.75000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 384.22 J/mol×K 273.00 Calculated Property
Cp,gas 460.33 J/mol×K 353.78 Calculated Property
Cp,gas 529.30 J/mol×K 434.56 Calculated Property
Cp,gas 591.28 J/mol×K 515.33 Calculated Property
Cp,gas 646.36 J/mol×K 596.11 Calculated Property
Cp,gas 694.68 J/mol×K 676.89 Calculated Property
Cp,gas 736.34 J/mol×K 757.67 Calculated Property
Cp,gas 771.48 J/mol×K 838.44 Calculated Property
Cp,gas 800.20 J/mol×K 919.22 Calculated Property
Cp,gas 822.63 J/mol×K 1000.00 Calculated Property

Similar Compounds

Diglycolic acid, 2-bromo-4-fluorophenyl decyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl octyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl nonyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl hexyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl pentyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl butyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl isohexyl ester. Diglycolic acid, 4-bromophenyl octyl ester. Diglycolic acid, 4-bromophenyl heptyl ester. Diglycolic acid, 4-bromophenyl hexyl ester. Diglycolic acid, 2-bromo-4-fluorophenyl propyl ester. Diglycolic acid, 4-bromophenyl pentyl ester. Sebacic acid, 2-bromo-4-fluorophenyl dodecyl ester. Sebacic acid, 2-bromo-4-fluorophenyl undecyl ester. Sebacic acid, 2-bromo-4-fluorophenyl hexyl ester.

Find more compounds similar to Diglycolic acid, 2-bromo-4-fluorophenyl heptyl ester.

Sources

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