Chemical Properties of 4-Butylbenzoic acid, 2,2,2-trichloroethyl ester

4-Butylbenzoic acid, 2,2,2-trichloroethyl ester

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InChI
InChI=1S/C13H15Cl3O2/c1-2-3-4-10-5-7-11(8-6-10)12(17)18-9-13(14,15)16/h5-8H,2-4,9H2,1H3
InChI Key
NPEJHXJLBOHWPV-UHFFFAOYSA-N
Formula
C13H15Cl3O2
SMILES
CCCCc1ccc(C(=O)OCC(Cl)(Cl)Cl)cc1
Molecular Weight1
309.62
Sources

Physical Properties

Property Value Unit Source
Δf -105.51 kJ/mol Joback Calculated Property
Δfgas -387.36 kJ/mol Joback Calculated Property
Δfus 31.04 kJ/mol Joback Calculated Property
Δvap 68.48 kJ/mol Joback Calculated Property
logPoct/wat 4.56 Crippen Calculated Property
Pc 2073.65 kPa Joback Calculated Property
Tboil 713.85 K Joback Calculated Property
Tc 939.31 K Joback Calculated Property
Tfus 439.55 K Joback Calculated Property
Vc 0.82 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 525.87 J/mol×K 713.85 Joback Calculated Property
η 0.00 Pa×s 713.85 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 1
-Cl 3
=CH- (ring) 4
=C< (ring) 2
-CH2- 4
>C< 1
-CH3 1
>C=O (nonring) 1

Similar Compounds

4-Butylbenzoic acid, ethyl ester. 4-Methylbenzoic acid, 2,2,2-trichloroethyl ester. Benzoic acid, 4-butyl-, methyl ester. 4-Butylbenzoic acid, 3-chloroprop-2-enyl ester. 4-Butylbenzoic acid, 3-methylbut-2-enyl ester. Terephthalic acid, di(2,2-dichloroethyl) ester. 4-Butylbenzoic acid, pentyl ester. 4-Butylbenzoic acid, pent-2-en-4-ynyl ester. 4-Butylbenzoic acid, 3-methylbutyl ester. 4-Butylbenzoic acid, hexyl ester. 4-Ethylbenzoic acid, ethyl ester. Ethanol, 2,2,2-trichloro-, benzoate. 4-Butylbenzoic acid, heptyl ester. 4-Butylbenzoic acid, decyl ester. 4-Butylbenzoic acid, tridecyl ester.

Find more compounds similar to 4-Butylbenzoic acid, 2,2,2-trichloroethyl ester.

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