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

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

PDF Excel Molecule Calculator
InChI
InChI=1S/C13H13FO2/c1-3-6-12(4-2)16-13(15)10-7-5-8-11(14)9-10/h5,7-9,12H,4H2,1-2H3
InChI Key
JMDVXLOXFREVAM-UHFFFAOYSA-N
Formula
C13H13FO2
SMILES
CC#CC(CC)OC(=O)c1cccc(F)c1
Molecular Weight1
220.24
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

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 1530.20 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

4-Fluorobenzoic acid, hex-4-yn-3-yl ester. 2-Fluorobenzoic acid, hex-4-yn-3-yl ester. 2,3,4-Trifluorobenzoic acid, hex-4-yn-3-yl ester. Isophthalic acid, di(hex-4-yn-3-yl) ester. Isophthalic acid, ethyl hex-4-yn-3-yl ester. Isophthalic acid, hex-4-yn-3-yl propyl ester. 3-Fluorobenzoic acid, 2-methyloct-5-yn-4-yl ester. 4-Cyanobenzoic acid, hex-4-yn-3-yl ester. 2,6-Difluorobenzoic acid, hex-4-yn-3-yl ester. 1-Naphthoic acid, hex-4-yn-3-yl ester. 4-Chlorobenzoic acid, hex-4-yn-3-yl ester. Isophthalic acid, hex-4-yn-3-yl isobutyl ester. 3-Bromobenzoic acid, hex-4-yn-3-yl ester. p-Toluic acid, hex-4-yn-3-yl ester. 2-Chlorobenzoic acid, hex-4-yn-3-yl ester.

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

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.