Chemical Properties of Phenol, 4-[1-ethyl-2-methyl-1-(1-methylpropyl)propyl]

Phenol, 4-[1-ethyl-2-methyl-1-(1-methylpropyl)propyl]

InChI
InChI=1S/C16H26O/c1-6-13(5)16(7-2,12(3)4)14-8-10-15(17)11-9-14/h8-13,17H,6-7H2,1-5H3
InChI Key
DDJFQXYNOJOKOE-UHFFFAOYSA-N
Formula
C16H26O
SMILES
CCC(C)C(CC)(c1ccc(O)cc1)C(C)C
Molecular Weight1
234.38
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Physical Properties

Property Value Unit Source
ΔfH°gas -262.10 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.56 kJ/mol Joback Calculated Property
ΔvapH° 87.15 kJ/mol Relay (1.0) Calculated Property
logPoct/wat 4.742 Crippen Calculated Property
McVol 218.410 ml/mol McGowan Calculated Property
Inp [1798.00; 1798.00]   Show Hide
Inp 1798.00 NIST
Inp 1798.00 NIST
Tboil 579.62 K Relay (1.0) Calculated Property
Tfus 390.99 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [302.44; 751.22] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-8.23180e+01
Coefficient B1.73720e+00
Coefficient C-1.31236e-03
Coefficient D4.08700e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 302.44 J/mol×K 273.00 Calculated Property
Cp,gas 386.11 J/mol×K 353.78 Calculated Property
Cp,gas 458.31 J/mol×K 434.56 Calculated Property
Cp,gas 520.33 J/mol×K 515.33 Calculated Property
Cp,gas 573.47 J/mol×K 596.11 Calculated Property
Cp,gas 619.03 J/mol×K 676.89 Calculated Property
Cp,gas 658.29 J/mol×K 757.67 Calculated Property
Cp,gas 692.55 J/mol×K 838.44 Calculated Property
Cp,gas 723.09 J/mol×K 919.22 Calculated Property
Cp,gas 751.22 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0023307; 0.0000201] Pa×s [380.64; 620.43] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.83550e+01
Coefficient B4.67938e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.380.64
Temperature range, max.620.43
η 0.0023307 Pa×s 380.64 Calculated Property
η 0.0010429 Pa×s 407.28 Calculated Property
η 0.0005151 Pa×s 433.93 Calculated Property
η 0.0002760 Pa×s 460.57 Calculated Property
η 0.0001584 Pa×s 487.21 Calculated Property
η 0.0000962 Pa×s 513.86 Calculated Property
η 0.0000614 Pa×s 540.50 Calculated Property
η 0.0000409 Pa×s 567.14 Calculated Property
η 0.0000282 Pa×s 593.78 Calculated Property
η 0.0000201 Pa×s 620.43 Calculated Property

Similar Compounds

Phenol, 4-(1,1-diethyl-2-methylbutyl). Phenol, 4-[1,2-dimethyl-1-(1-methylethyl)butyl]. Phenol, 4-(1,2-diethyl-1-methylbutyl). Phenol, 4-(1-propyl-1,2-dimethylbutyl). Phenol, 4-(1-ethyl-1,2-dimethylpentyl). Phenol, 4-(1-ethyl-1,2,3-trimethylbutyl). Phenol, 4-[1-ethyl-1-(1-methylethyl)butyl]. Phenol, 4-(2-ethyl-1,1-dimethylbutyl). Phenol, 4-(1,1,2-trimethylhexyl). Phenol, 4-(2-ethyl-1,1-dimethylpentyl). Phenol, 4-(1,1,2,3-tetramethylpentyl), diastereomer # 2. Phenol, 4-(1,1,2,3-tetramethylpentyl), diastereomer # 1. Phenol, 4-[1,3-dimethyl-1-(1-methylethyl)butyl]. Phenol, 4-[1-methyl-1-(1-methylethyl)pentyl]. Phenol, 4-(1,1,2,4-tetramethylpentyl).

Find more compounds similar to Phenol, 4-[1-ethyl-2-methyl-1-(1-methylpropyl)propyl].

Sources

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