Chemical Properties of 2,3,4-Trifluorobenzoic acid, hex-4-yn-3-yl ester

2,3,4-Trifluorobenzoic acid, hex-4-yn-3-yl ester

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InChI
InChI=1S/C13H11F3O2/c1-3-5-8(4-2)18-13(17)9-6-7-10(14)12(16)11(9)15/h6-8H,4H2,1-2H3
InChI Key
GNXAAQHQJHHCOH-UHFFFAOYSA-N
Formula
C13H11F3O2
SMILES
CC#CC(CC)OC(=O)c1ccc(F)c(F)c1F
Molecular Weight1
256.22

Physical Properties

Property Value Unit Source
Δf -475.89 kJ/mol Joback Calculated Property
Δfgas -675.64 kJ/mol Joback Calculated Property
Δfus 33.93 kJ/mol Joback Calculated Property
Δvap 57.26 kJ/mol Joback Calculated Property
log10WS -4.71 Crippen Calculated Property
logPoct/wat 3.063 Crippen Calculated Property
McVol 174.420 ml/mol McGowan Calculated Property
Pc 2265.42 kPa Joback Calculated Property
Inp [1522.70; 1522.70]   Show Hide
Inp 1522.70 NIST
Inp 1522.70 NIST
Tboil 621.12 K Joback Calculated Property
Tc 825.25 K Joback Calculated Property
Tfus 465.28 K Joback Calculated Property
Vc 0.690 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [426.07; 492.36] J/mol×K [621.12; 825.25] Show Hide
Cp,gas 426.07 J/mol×K 621.12 Joback Calculated Property
Cp,gas 438.79 J/mol×K 655.14 Joback Calculated Property
Cp,gas 450.84 J/mol×K 689.16 Joback Calculated Property
Cp,gas 462.22 J/mol×K 723.18 Joback Calculated Property
Cp,gas 472.93 J/mol×K 757.21 Joback Calculated Property
Cp,gas 482.97 J/mol×K 791.23 Joback Calculated Property
Cp,gas 492.36 J/mol×K 825.25 Joback Calculated Property

Similar Compounds

2-Fluorobenzoic acid, hex-4-yn-3-yl ester. 3-Fluorobenzoic acid, hex-4-yn-3-yl ester. 2,3,4-Trifluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2,6-Difluorobenzoic acid, hex-4-yn-3-yl ester. 4-Fluorobenzoic acid, hex-4-yn-3-yl ester. Pentafluorobenzoic acid, hex-4-yn-3-yl ester. 2,3,4-Trifluorobenzoic acid, 2,7-dimethyloct-7-en-5-yn-4-yl ester. 2,3,4-Trifluorobenzoic acid, but-3-yn-2-yl ester. 2,3,4-Trifluorobenzoic acid, 2,6-dimethylnon-1-en-3-yn-5-yl ester. 2-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2,3,4-Trifluorobenzoic acid, tridec-2-ynyl ester. 2,4-Difluorobenzoic acid, 2-pentyl ester. 3-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2,6-Difluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 2,4-Difluorobenzoic acid, 3-tridecyl ester.

Find more compounds similar to 2,3,4-Trifluorobenzoic acid, hex-4-yn-3-yl ester.

Sources

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