Chemical Properties of 2,6-Difluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester

2,6-Difluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester

InChI
InChI=1S/C17H18F2O2/c1-11(2)8-9-13(10-12(3)4)21-17(20)16-14(18)6-5-7-15(16)19/h5-7,12-13H,1,10H2,2-4H3
InChI Key
HJVYDGWGOMWMLH-UHFFFAOYSA-N
Formula
C17H18F2O2
SMILES
C=C(C)C#CC(CC(C)C)OC(=O)c1c(F)cccc1F
Molecular Weight1
292.32
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Physical Properties

Property Value Unit Source
ΔfusH° 37.06 kJ/mol Joback Calculated Property
logPoct/wat 4.116 Crippen Calculated Property
McVol 224.710 ml/mol McGowan Calculated Property
Inp [1777.80; 1777.80]   Show Hide
Inp 1777.80 NIST
Inp 1777.80 NIST

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [319.51; 705.19] 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 A3.12310e+01
Coefficient B1.23166e+00
Coefficient C-6.75780e-04
Coefficient D1.18080e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 319.51 J/mol×K 273.00 Calculated Property
Cp,gas 387.61 J/mol×K 353.78 Calculated Property
Cp,gas 448.53 J/mol×K 434.56 Calculated Property
Cp,gas 502.64 J/mol×K 515.33 Calculated Property
Cp,gas 550.31 J/mol×K 596.11 Calculated Property
Cp,gas 591.92 J/mol×K 676.89 Calculated Property
Cp,gas 627.84 J/mol×K 757.67 Calculated Property
Cp,gas 658.44 J/mol×K 838.44 Calculated Property
Cp,gas 684.10 J/mol×K 919.22 Calculated Property
Cp,gas 705.19 J/mol×K 1000.00 Calculated Property

Similar Compounds

2,6-Difluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2-Fluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2,3,4-Trifluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2,6-Difluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 3-fluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 4-Fluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2,3,4-trifluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. Pentafluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2-Fluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 4-Cyanobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2,3,4-trifluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, di(2,7-dimethyloct-7-en-5-yn-4-yl) ester. 4-Nitrobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 4-Bromobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester.

Find more compounds similar to 2,6-Difluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester.

Sources

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