Chemical Properties of 3-Fluorobenzoic acid, 3-methylbutyl ester

3-Fluorobenzoic acid, 3-methylbutyl ester

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InChI
InChI=1S/C12H15FO2/c1-9(2)6-7-15-12(14)10-4-3-5-11(13)8-10/h3-5,8-9H,6-7H2,1-2H3
InChI Key
CAVZEARYKBBVBP-UHFFFAOYSA-N
Formula
C12H15FO2
SMILES
CC(C)CCOC(=O)c1cccc(F)c1
Molecular Weight1
210.24
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Physical Properties

Property Value Unit Source
Δf -278.23 kJ/mol Joback Calculated Property
Δfgas -512.14 kJ/mol Joback Calculated Property
Δfus 22.83 kJ/mol Joback Calculated Property
Δvap 53.20 kJ/mol Joback Calculated Property
log10WS -3.48 Crippen Calculated Property
logPoct/wat 3.029 Crippen Calculated Property
McVol 165.390 ml/mol McGowan Calculated Property
Pc 2391.19 kPa Joback Calculated Property
Inp [1457.00; 1457.00]   Show Hide
Inp 1457.00 NIST
Inp 1457.00 NIST
Tboil 580.74 K Joback Calculated Property
Tc 782.26 K Joback Calculated Property
Tfus 321.69 K Joback Calculated Property
Vc 0.635 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [402.33; 478.23] J/mol×K [580.74; 782.26] Show Hide
Cp,gas 402.33 J/mol×K 580.74 Joback Calculated Property
Cp,gas 416.88 J/mol×K 614.33 Joback Calculated Property
Cp,gas 430.65 J/mol×K 647.91 Joback Calculated Property
Cp,gas 443.66 J/mol×K 681.50 Joback Calculated Property
Cp,gas 455.91 J/mol×K 715.09 Joback Calculated Property
Cp,gas 467.43 J/mol×K 748.67 Joback Calculated Property
Cp,gas 478.23 J/mol×K 782.26 Joback Calculated Property

Similar Compounds

4-Fluorobenzoic acid, 3-methylbutyl ester. 2-Fluorobenzoic acid, 3-methylbutyl ester. 3-Fluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 1-Butanol, 3-methyl-, benzoate. 2,4-Difluorobenzoic acid, 3-methylbutyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 3-methylbutyl ester. 3,4-Difluorobenzoic acid, butyl ester. Isophthalic acid, ethyl 3-methylbutyl ester. Isophthalic acid, butyl 3-methylbutyl ester. 3-Fluorobenzoic acid, 2-methylpentyl ester. Terephthalic acid, ethyl 3-methylbutyl ester. Terephthalic acid, di(3-methylbutyl) ester. 3,4-Difluorobenzoic acid, pentyl ester. 3,4-Difluorobenzoic acid, hexyl ester. 3,4-Difluorobenzoic acid, heptyl ester.

Find more compounds similar to 3-Fluorobenzoic acid, 3-methylbutyl ester.

Sources

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