Chemical Properties of 3-Methoxybenzoic acid, 2-(trifluoromethyl)benzyl ester

3-Methoxybenzoic acid, 2-(trifluoromethyl)benzyl ester

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InChI
InChI=1S/C16H13F3O3/c1-21-13-7-4-6-11(9-13)15(20)22-10-12-5-2-3-8-14(12)16(17,18)19/h2-9H,10H2,1H3
InChI Key
XIQQOCPUWOYQOR-UHFFFAOYSA-N
Formula
C16H13F3O3
SMILES
COc1cccc(C(=O)OCc2ccccc2C(F)(F)F)c1
Molecular Weight1
310.27
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Physical Properties

Property Value Unit Source
Δf -631.11 kJ/mol Joback Calculated Property
Δfgas -897.55 kJ/mol Joback Calculated Property
Δfus 30.30 kJ/mol Joback Calculated Property
Δvap 64.91 kJ/mol Joback Calculated Property
log10WS -5.05 Crippen Calculated Property
logPoct/wat 4.071 Crippen Calculated Property
McVol 207.400 ml/mol McGowan Calculated Property
Pc 2049.31 kPa Joback Calculated Property
Inp [2002.00; 2002.00]   Show Hide
Inp 2002.00 NIST
Inp 2002.00 NIST
Tboil 722.09 K Joback Calculated Property
Tc 937.12 K Joback Calculated Property
Tfus 446.54 K Joback Calculated Property
Vc 0.800 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [569.53; 636.87] J/mol×K [722.09; 937.12] Show Hide
Cp,gas 569.53 J/mol×K 722.09 Joback Calculated Property
Cp,gas 583.27 J/mol×K 757.93 Joback Calculated Property
Cp,gas 595.94 J/mol×K 793.77 Joback Calculated Property
Cp,gas 607.60 J/mol×K 829.61 Joback Calculated Property
Cp,gas 618.28 J/mol×K 865.45 Joback Calculated Property
Cp,gas 628.02 J/mol×K 901.29 Joback Calculated Property
Cp,gas 636.87 J/mol×K 937.12 Joback Calculated Property

Similar Compounds

3-Methoxybenzoic acid, 2-fluoro-6-(trifluoromethyl)benzyl ester. Benzoic acid, (2-(trifluoromethyl)phenyl)methyl ester. Phthalic acid, di(3-methoxybenzyl) ester. Phthalic acid, di(2-trifluorobenzyl) ester. 3-Methoxybenzoic acid, 3-bromobenzyl ester. 2-(Methylthio)benzoic acid, 2-(trifluoromethyl)benzyl ester. 4-(Methylthio)benzoic acid, 2-(trifluoromethyl)benzyl ester. Phthalic acid, ethyl 2-trifluoromethylbenzyl ester. Phthalic acid, ethyl 3-methoxybenzyl ester. 3-Methoxybenzoic acid, 3-chlorobenzyl ester. Phthalic acid, di(2-methoxybenzyl) ester. Phthalic acid, isobutyl 2-trifluoromethylbenzyl ester. Phthalic acid, propyl 2-trifluoromethylbenzyl ester. Phthalic acid, butyl 2-trifluoromethylbenzyl ester. Phthalic acid, isobutyl 3-methoxybenzyl ester.

Find more compounds similar to 3-Methoxybenzoic acid, 2-(trifluoromethyl)benzyl ester.

Sources

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