Chemical Properties of 2,5-Di(trifluoromethyl)benzoic acid, 4-cyanophenyl ester

2,5-Di(trifluoromethyl)benzoic acid, 4-cyanophenyl ester

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InChI
InChI=1S/C16H7F6NO2/c17-15(18,19)10-3-6-13(16(20,21)22)12(7-10)14(24)25-11-4-1-9(8-23)2-5-11/h1-7H
InChI Key
WJHYCQRXQOKJCW-UHFFFAOYSA-N
Formula
C16H7F6NO2
SMILES
N#Cc1ccc(OC(=O)c2cc(C(F)(F)F)ccc2C(F)(F)F)cc1
Molecular Weight1
359.22
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Physical Properties

Property Value Unit Source
Δf -984.15 kJ/mol Joback Calculated Property
Δfgas -1209.00 kJ/mol Joback Calculated Property
Δfus 32.06 kJ/mol Joback Calculated Property
Δvap 69.89 kJ/mol Joback Calculated Property
log10WS -6.12 Crippen Calculated Property
logPoct/wat 4.815 Crippen Calculated Property
McVol 208.220 ml/mol McGowan Calculated Property
Pc 1813.86 kPa Joback Calculated Property
Inp [1855.00; 1855.00]   Show Hide
Inp 1855.00 NIST
Inp 1855.00 NIST
Tboil 801.31 K Joback Calculated Property
Tc 1016.66 K Joback Calculated Property
Tfus 506.01 K Joback Calculated Property
Vc 0.852 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [585.51; 630.64] J/mol×K [801.31; 1016.66] Show Hide
Cp,gas 585.51 J/mol×K 801.31 Joback Calculated Property
Cp,gas 594.91 J/mol×K 837.20 Joback Calculated Property
Cp,gas 603.46 J/mol×K 873.09 Joback Calculated Property
Cp,gas 611.23 J/mol×K 908.99 Joback Calculated Property
Cp,gas 618.31 J/mol×K 944.88 Joback Calculated Property
Cp,gas 624.75 J/mol×K 980.77 Joback Calculated Property
Cp,gas 630.64 J/mol×K 1016.66 Joback Calculated Property

Similar Compounds

2,5-Di(trifluoromethyl)benzoic acid, phenyl ester. 2-Trifluoromethylbenzoic acid, 4-cyanophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-chlorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-nitrophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3,4-dimethylphenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-methylphenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3-fluorophenyl ester. 2-Trifluoromethylbenzoic acid, phenyl ester. 3-Trifluoromethylbenzoic acid, 4-cyanophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3,4-dichlorophenyl ester. 5-Fluoro-2-trifluoromethylbenzoic acid, 4-cyanophenyl ester. 4-Fluoro-2-trifluoromethylbenzoic acid, 4-cyanophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3,5-difluophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 3,5-dimethylphenyl ester. 2,5-Ditrifluoromethylbenzoic acid, 4-benzyloxyphenyl ester.

Find more compounds similar to 2,5-Di(trifluoromethyl)benzoic acid, 4-cyanophenyl ester.

Sources

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