Chemical Properties of Benzenesulphonic acid, 4-(3-dodecyl)-, methyl ester

Benzenesulphonic acid, 4-(3-dodecyl)-, methyl ester

InChI
InChI=1S/C19H32O3S/c1-4-6-7-8-9-10-11-12-17(5-2)18-13-15-19(16-14-18)23(20,21)22-3/h13-17H,4-12H2,1-3H3
InChI Key
RXGVBSSJMOZDLS-UHFFFAOYSA-N
Formula
C19H32O3S
SMILES
CCCCCCCCCC(CC)c1ccc(S(=O)(=O)OC)cc1
Molecular Weight1
340.52
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Physical Properties

Property Value Unit Source
ω 0.8864 Relay (1.0) Calculated Property
ΔfG° -364.10 kJ/mol Joback Calculated Property
ΔfH°gas -668.64 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 47.66 kJ/mol Joback Calculated Property
ΔvapH° 114.59 kJ/mol Relay (1.0) Calculated Property
IE 8.93 eV Relay (1.0) Calculated Property
log10WS -6.16 Relay (1.0) Calculated Property
logPoct/wat 5.656 Crippen Calculated Property
McVol 288.770 ml/mol McGowan Calculated Property
Pc 1502.31 kPa Joback Calculated Property
Inp 2529.00 NIST
Tboil 654.82 K Relay (1.0) Calculated Property
Tc 868.07 K Relay (1.0) Calculated Property
Tfus 328.41 K Relay (1.0) Calculated Property
Vc 1.051 m3/kmol Relay (1.0) Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [839.80; 936.46] J/mol×K [735.54; 921.06] Show Hide
Cp,gas 839.80 J/mol×K 735.54 Joback Calculated Property
Cp,gas 858.61 J/mol×K 766.46 Joback Calculated Property
Cp,gas 876.32 J/mol×K 797.38 Joback Calculated Property
Cp,gas 892.95 J/mol×K 828.30 Joback Calculated Property
Cp,gas 908.50 J/mol×K 859.22 Joback Calculated Property
Cp,gas 923.00 J/mol×K 890.14 Joback Calculated Property
Cp,gas 936.46 J/mol×K 921.06 Joback Calculated Property

Similar Compounds

Benzenesulphonic acid, 4-(3-tridecyl)-, methyl ester. Benzenesulphonic acid, 4-(3-undecyl)-, methyl ester. Benzenesulphonic acid, 4-(3-decyl)-, methyl ester. Benzenesulphonic acid, 4-(4-undecyl)-, methyl ester. Benzenesulphonic acid, 4-(5-undecyl)-, methyl ester. Benzenesulphonic acid, 4-(6-dodecyl)-, methyl ester. Benzenesulphonic acid, 4-(4-dodecyl)-, methyl ester. Benzenesulphonic acid, 4-(7-tridecyl)-, methyl ester. Benzenesulphonic acid, 4-(5-decyl)-, methyl ester. Phenol, 4-[1-(1-methylethyl)hexyl]. Phenol, 4-(2-methyl-1-propylpentyl). Phenol, 4-(1-ethyl-2-methylhexyl). Phenol, 4-[1-(1-methylpropyl)pentyl]. Phenol, 4-[3-methyl-1-(1-methylethyl)pentyl]. 4-(3-Decyl)phenol.

Find more compounds similar to Benzenesulphonic acid, 4-(3-dodecyl)-, methyl ester.

Sources

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