Chemical Properties of 4-n-Octylphenol, pentafluorobenzoyl ester

4-n-Octylphenol, pentafluorobenzoyl ester

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InChI
InChI=1S/C21H21F5O2/c1-2-3-4-5-6-7-8-13-9-11-14(12-10-13)28-21(27)15-16(22)18(24)20(26)19(25)17(15)23/h9-12H,2-8H2,1H3
InChI Key
UHNTZIMKJXDBPJ-UHFFFAOYSA-N
Formula
C21H21F5O2
SMILES
CCCCCCCCc1ccc(OC(=O)c2c(F)c(F)c(F)c(F)c2F)cc1
Molecular Weight1
400.38
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Physical Properties

Property Value Unit Source
Δf -914.99 kJ/mol Joback Calculated Property
Δfgas -1297.88 kJ/mol Joback Calculated Property
Δfus 54.08 kJ/mol Joback Calculated Property
Δvap 75.94 kJ/mol Joback Calculated Property
log10WS -8.53 Crippen Calculated Property
logPoct/wat 6.504 Crippen Calculated Property
McVol 275.520 ml/mol McGowan Calculated Property
Pc 1238.96 kPa Joback Calculated Property
Inp [2281.10; 2287.90]   Show Hide
Inp 2281.10 NIST
Inp 2284.50 NIST
Inp 2287.90 NIST
Inp 2281.10 NIST
Tboil 835.76 K Joback Calculated Property
Tc 1031.00 K Joback Calculated Property
Tfus 529.50 K Joback Calculated Property
Vc 1.109 m3/kmol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [828.81; 899.31] J/mol×K [835.76; 1031.00] Show Hide
Cp,gas 828.81 J/mol×K 835.76 Joback Calculated Property
Cp,gas 842.92 J/mol×K 868.30 Joback Calculated Property
Cp,gas 856.06 J/mol×K 900.84 Joback Calculated Property
Cp,gas 868.24 J/mol×K 933.38 Joback Calculated Property
Cp,gas 879.50 J/mol×K 965.92 Joback Calculated Property
Cp,gas 889.85 J/mol×K 998.46 Joback Calculated Property
Cp,gas 899.31 J/mol×K 1031.00 Joback Calculated Property

Similar Compounds

4-n-Nonylphenol, pentafluorobenzoyl ester. 4-n-Heptylphenol, pentafluorobenzoyl ester. 4-n-Hexylphenol, pentafluorobenzoyl ester. 4-n-Pentylphenol, pentafluorobenzoyl ester. 4-n-Butylphenol, pentafluorobenzoyl ester. 4-n-Propylphenol, pentafluorobenzoyl ester. Salicylic acid, p-octylphenyl ester. 4-sec-Butylphenol, pentafluorobenzoyl ester. 3-n-Propylphenol, pentafluorobenzoyl ester. 4(1,1-Dimethylhexyl)phenol, pentafluorobenzoyl ester. 4(1,1-Dimethylpentyl)phenol, pentafluorobenzoyl ester. 4(1,1-Dimethylbutyl)phenol, pentafluorobenzoyl ester. Pentafluorobenzoic acid, 2-propylphenyl ester. 4(1,2,2-Trimethylpropyl)phenol, pentafluorobenzoyl ester. Benzoic acid, 4-butyl-, 4-cyanophenyl ester.

Find more compounds similar to 4-n-Octylphenol, pentafluorobenzoyl ester.

Sources

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