Chemical Properties of Dichlorophen, O,O'-di(3-trifluoromethylbenzoyl)-

Dichlorophen, O,O'-di(3-trifluoromethylbenzoyl)-

InChI
InChI=1S/C29H16Cl2F6O4/c30-22-7-9-24(40-26(38)16-3-1-5-20(12-16)28(32,33)34)18(14-22)11-19-15-23(31)8-10-25(19)41-27(39)17-4-2-6-21(13-17)29(35,36)37/h1-10,12-15H,11H2
InChI Key
NWSJXVYBCWVKAI-UHFFFAOYSA-N
Formula
C29H16Cl2F6O4
SMILES
O=C(Oc1ccc(Cl)cc1Cc1cc(Cl)ccc1OC(=O)c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1
Molecular Weight1
613.33
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Physical Properties

Property Value Unit Source
ΔfusH° 65.48 kJ/mol Joback Calculated Property
IE 8.69 eV Relay (1.0) Calculated Property
logPoct/wat 9.060 Crippen Calculated Property
McVol 374.410 ml/mol McGowan Calculated Property
Inp [3316.00; 3316.00]   Show Hide
Inp 3316.00 NIST
Inp 3316.00 NIST
Tboil 789.34 K Relay (1.0) Calculated Property
Tfus 414.62 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [1137.93; 1163.92] J/mol×K [1180.18; 1445.00] Show Hide
Cp,gas 1137.93 J/mol×K 1180.18 Joback Calculated Property
Cp,gas 1143.76 J/mol×K 1224.32 Joback Calculated Property
Cp,gas 1148.74 J/mol×K 1268.45 Joback Calculated Property
Cp,gas 1153.06 J/mol×K 1312.59 Joback Calculated Property
Cp,gas 1156.90 J/mol×K 1356.73 Joback Calculated Property
Cp,gas 1160.46 J/mol×K 1400.87 Joback Calculated Property
Cp,gas 1163.92 J/mol×K 1445.00 Joback Calculated Property

Similar Compounds

Dichlorophen, O-(3-trifluoromethylbenzoyl)-. Dichlorophen, O,O'-(2-trifluoromethylbenzoyl)-. Dichlorophen, O-(2-trifluoromethylbenzoyl)-. Dichlorophen, O,O'-di(4-methylbenzoyl)-. Dichlorphen, O,O'-dibenzoyl-. Dichlorphen, O,O'-bis(3-Fluoro-4-trifluoromethylbenzoyl)-. Dichlorophen, O,O'-(4-fluorobenzoyl)-. Dichlorophen, O,O'-di(3-fluorobenzoyl)-. Dichlorphen, O,O'-bis(2,4-difluorobenzoyl)-. 2,5-Di(trifluoromethyl)benzoic acid, 4-chloro-2-methylphenyl ester. Dichlorophen, O,O'-di(2-furoyl)-. Dichlorphen, O,O'-di(pentafluorobenzoyl)-. 4-Fluoro-2-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester. 6-Fluoro-3-trifluoromethylbenzoic acid, 4-chloro-2-methylphenyl ester. 3-Fluoro-5-trifluoromethylbenzoic acid, 2-(1-phenyleth-1-yl)-4-methoxyphenyl ester.

Find more compounds similar to Dichlorophen, O,O'-di(3-trifluoromethylbenzoyl)-.

Sources

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