Chemical Properties of 2-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester

2-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester

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InChI
InChI=1S/C16H19FO2/c1-4-5-8-13(11-12(2)3)19-16(18)14-9-6-7-10-15(14)17/h6-7,9-10,12-13H,4,11H2,1-3H3
InChI Key
PSAIZRUZRDMMTE-UHFFFAOYSA-N
Formula
C16H19FO2
SMILES
CCC#CC(CC(C)C)OC(=O)c1ccccc1F
Molecular Weight1
262.32

Physical Properties

Property Value Unit Source
Δf -44.19 kJ/mol Joback Calculated Property
Δfgas -327.68 kJ/mol Joback Calculated Property
Δfus 32.79 kJ/mol Joback Calculated Property
Δvap 63.86 kJ/mol Joback Calculated Property
log10WS -5.06 Crippen Calculated Property
logPoct/wat 3.811 Crippen Calculated Property
McVol 213.150 ml/mol McGowan Calculated Property
Pc 1956.14 kPa Joback Calculated Property
Inp [1724.00; 1724.00]   Show Hide
Inp 1724.00 NIST
Inp 1724.00 NIST
Tboil 680.82 K Joback Calculated Property
Tc 895.79 K Joback Calculated Property
Tfus 457.87 K Joback Calculated Property
Vc 0.816 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [564.99; 648.90] J/mol×K [680.82; 895.79] Show Hide
Cp,gas 564.99 J/mol×K 680.82 Joback Calculated Property
Cp,gas 581.44 J/mol×K 716.65 Joback Calculated Property
Cp,gas 596.86 J/mol×K 752.48 Joback Calculated Property
Cp,gas 611.29 J/mol×K 788.31 Joback Calculated Property
Cp,gas 624.76 J/mol×K 824.14 Joback Calculated Property
Cp,gas 637.29 J/mol×K 859.96 Joback Calculated Property
Cp,gas 648.90 J/mol×K 895.79 Joback Calculated Property

Similar Compounds

2-Fluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 3-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2,6-Difluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2,3,4-Trifluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 4-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 3-Fluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 4-Fluorobenzoic 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. 2,3,4-Trifluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. Isophthalic acid, di(2-methyloct-5-yn-4-yl) ester. 4-Cyanobenzoic acid, 2-methyloct-5-yn-4-yl ester. Isophthalic acid, ethyl 2-methyloct-5-yn-4-yl ester. Isophthalic acid, isobutyl 2-methyloct-5-yn-4-yl ester. 2-Fluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. Isophthalic acid, 2-methyloct-5-yn-4-yl propyl ester.

Find more compounds similar to 2-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester.

Sources

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