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

4-Fluorobenzoic acid, hex-4-yn-3-yl ester

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InChI
InChI=1S/C13H13FO2/c1-3-5-12(4-2)16-13(15)10-6-8-11(14)9-7-10/h6-9,12H,4H2,1-2H3
InChI Key
AJMAEIVRXGRLOS-UHFFFAOYSA-N
Formula
C13H13FO2
SMILES
CC#CC(CC)OC(=O)c1ccc(F)cc1
Molecular Weight1
220.24

Physical Properties

Property Value Unit Source
Δf -67.01 kJ/mol Joback Calculated Property
Δfgas -260.48 kJ/mol Joback Calculated Property
Δfus 28.54 kJ/mol Joback Calculated Property
Δvap 57.57 kJ/mol Joback Calculated Property
log10WS -4.05 Crippen Calculated Property
logPoct/wat 2.784 Crippen Calculated Property
McVol 170.880 ml/mol McGowan Calculated Property
Pc 2548.19 kPa Joback Calculated Property
Inp [1499.00; 1499.00]   Show Hide
Inp 1499.00 NIST
Inp 1499.00 NIST
Tboil 612.62 K Joback Calculated Property
Tc 834.59 K Joback Calculated Property
Tfus 439.06 K Joback Calculated Property
Vc 0.653 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [411.31; 485.56] J/mol×K [612.62; 834.59] Show Hide
Cp,gas 411.31 J/mol×K 612.62 Joback Calculated Property
Cp,gas 425.81 J/mol×K 649.62 Joback Calculated Property
Cp,gas 439.43 J/mol×K 686.61 Joback Calculated Property
Cp,gas 452.20 J/mol×K 723.61 Joback Calculated Property
Cp,gas 464.13 J/mol×K 760.60 Joback Calculated Property
Cp,gas 475.25 J/mol×K 797.60 Joback Calculated Property
Cp,gas 485.56 J/mol×K 834.59 Joback Calculated Property

Similar Compounds

3-Fluorobenzoic acid, hex-4-yn-3-yl ester. 2-Fluorobenzoic acid, hex-4-yn-3-yl ester. 4-Cyanobenzoic acid, hex-4-yn-3-yl ester. Isophthalic acid, di(hex-4-yn-3-yl) ester. 4-(Trifluoromethyl)benzoic acid, hex-4-yn-3-yl ester. 4-Chlorobenzoic acid, hex-4-yn-3-yl ester. 4-Bromobenzoic acid, hex-4-yn-3-yl ester. Isophthalic acid, ethyl hex-4-yn-3-yl ester. p-Toluic acid, hex-4-yn-3-yl ester. Isophthalic acid, hex-4-yn-3-yl propyl ester. 2,3,4-Trifluorobenzoic acid, hex-4-yn-3-yl ester. p-Anisic acid, hex-4-yn-3-yl ester. Isophthalic acid, hex-4-yn-3-yl isobutyl ester. 3-Trifluoromethylbenzoic acid, hex-4-yn-3-yl ester. 3-Bromobenzoic acid, hex-4-yn-3-yl ester.

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

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