Chemical Properties of 3-Fluorobenzoic acid, 4-methoxy-2-methylbutyl ester

3-Fluorobenzoic acid, 4-methoxy-2-methylbutyl ester

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InChI
InChI=1S/C13H17FO3/c1-10(6-7-16-2)9-17-13(15)11-4-3-5-12(14)8-11/h3-5,8,10H,6-7,9H2,1-2H3
InChI Key
BZIRZKZQTYWOSX-UHFFFAOYSA-N
Formula
C13H17FO3
SMILES
COCCC(C)COC(=O)c1cccc(F)c1
Molecular Weight1
240.27
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Physical Properties

Property Value Unit Source
Δf -374.81 kJ/mol Joback Calculated Property
Δfgas -665.00 kJ/mol Joback Calculated Property
Δfus 26.61 kJ/mol Joback Calculated Property
Δvap 57.83 kJ/mol Joback Calculated Property
log10WS -2.98 Crippen Calculated Property
logPoct/wat 2.655 Crippen Calculated Property
McVol 185.350 ml/mol McGowan Calculated Property
Pc 2147.32 kPa Joback Calculated Property
Inp [1664.00; 1664.00]   Show Hide
Inp 1664.00 NIST
Inp 1664.00 NIST
Tboil 626.04 K Joback Calculated Property
Tc 823.10 K Joback Calculated Property
Tfus 355.19 K Joback Calculated Property
Vc 0.710 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [477.93; 555.60] J/mol×K [626.04; 823.10] Show Hide
Cp,gas 477.93 J/mol×K 626.04 Joback Calculated Property
Cp,gas 492.83 J/mol×K 658.88 Joback Calculated Property
Cp,gas 506.94 J/mol×K 691.73 Joback Calculated Property
Cp,gas 520.26 J/mol×K 724.57 Joback Calculated Property
Cp,gas 532.81 J/mol×K 757.41 Joback Calculated Property
Cp,gas 544.59 J/mol×K 790.26 Joback Calculated Property
Cp,gas 555.60 J/mol×K 823.10 Joback Calculated Property

Similar Compounds

4-Fluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 2,4-Difluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 4-methoxy-2-methylbutyl ester. 3-Fluorobenzoic acid, 3-methylbutyl ester. 3-Fluorobenzoic acid, 2-methylpentyl ester. Benzoic acid, 3-methyl-, 4-methoxy-2-methylbutyl ester. 3-Trifluoromethylbenzoic acid, 4-methoxy-2-methylbutyl ester. 4-Chlorobenzoic acid, 4-methoxy-2-methylbutyl ester. 4-Methylbenzoic acid, 4-methoxy-2-methylbutyl ester. 3-Bromobenzoic acid, 4-methoxy-2-methylbutyl ester. 1-Naphthoic acid, 4-methoxy-2-methylbutyl ester. 3-Chloro-2-fluorobenzoic acid, 4-methoxy-2-methylbutyl ester. 2-Chlorobenzoic acid, 4-methoxy-2-methylbutyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2-methylbutyl ester. Isophthalic acid, butyl 2-methylbutyl ester.

Find more compounds similar to 3-Fluorobenzoic acid, 4-methoxy-2-methylbutyl ester.

Sources

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