Chemical Properties of 2,5-Di(trifluoromethyl)benzoic acid, 2,4-dichloro-6-formylphenyl ester

2,5-Di(trifluoromethyl)benzoic acid, 2,4-dichloro-6-formylphenyl ester

InChI
InChI=1S/C16H6Cl2F6O3/c17-9-3-7(6-25)13(12(18)5-9)27-14(26)10-4-8(15(19,20)21)1-2-11(10)16(22,23)24/h1-6H
InChI Key
FJONLBRHBXRTAS-UHFFFAOYSA-N
Formula
C16H6Cl2F6O3
SMILES
O=Cc1cc(Cl)cc(Cl)c1OC(=O)c1cc(C(F)(F)F)ccc1C(F)(F)F
Molecular Weight1
431.11
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Physical Properties

Property Value Unit Source
ω 0.7977 Relay (1.0) Calculated Property
ΔfG° -1259.97 kJ/mol Joback Calculated Property
ΔfH°gas -1582.59 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 40.46 kJ/mol Joback Calculated Property
ΔvapH° 94.11 kJ/mol Relay (1.0) Calculated Property
IE 9.55 eV Relay (1.0) Calculated Property
log10WS -6.92 Relay (1.0) Calculated Property
logPoct/wat 6.063 Crippen Calculated Property
McVol 232.890 ml/mol McGowan Calculated Property
Pc 1806.16 kPa Joback Calculated Property
Inp 2054.00 NIST
Tboil 604.61 K Relay (1.0) Calculated Property
Tc 910.08 K Relay (1.0) Calculated Property
Tfus 364.47 K Relay (1.0) Calculated Property
Vc 0.853 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [619.95; 659.55] J/mol×K [832.71; 1047.45] Show Hide
Cp,gas 619.95 J/mol×K 832.71 Joback Calculated Property
Cp,gas 628.30 J/mol×K 868.50 Joback Calculated Property
Cp,gas 635.87 J/mol×K 904.29 Joback Calculated Property
Cp,gas 642.71 J/mol×K 940.08 Joback Calculated Property
Cp,gas 648.90 J/mol×K 975.87 Joback Calculated Property
Cp,gas 654.49 J/mol×K 1011.66 Joback Calculated Property
Cp,gas 659.55 J/mol×K 1047.45 Joback Calculated Property

Similar Compounds

6-Fluoro-3-trifluoromethylbenzoic acid, 2-formyl-4,6-dichlorophenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 4-chloro-2-methylphenyl ester. 6-Fluoro-2-trifluoromethylbenzoic acid, 2-formyl-4,6-dichlorophenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 2,4-dichloro-6-formylphenyl ester. 3-Fluoro-4-trifluoromethylbenzoic acid, 2,4-dichloro-6-formylphenyl ester. 2,5-Di(trifluoromethyl)benzoic acid, 2,4-dichloronaphth-1-yl ester. Dichlorophen, O-(2-trifluoromethylbenzoyl)-. Dichlorophen, O,O'-(2-trifluoromethylbenzoyl)-. 2,5-Di(trifluoromethyl)benzoic acid, 2,3-dichlorophenyl ester. Dichlorophen, O-(3-trifluoromethylbenzoyl)-. Dichlorophen, O,O'-di(3-trifluoromethylbenzoyl)-. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 3-Fluoro-6-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. (R)-1,2-Dimethoxy-6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline. Nabilone, tert-butyldimethylsilyl ether.

Find more compounds similar to 2,5-Di(trifluoromethyl)benzoic acid, 2,4-dichloro-6-formylphenyl ester.

Sources

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