Chemical Properties of 1-(4-Isobutylphenyl)-1-ethanol, methyl

1-(4-Isobutylphenyl)-1-ethanol, methyl

InChI
InChI=1S/C13H20O/c1-10(2)9-12-5-7-13(8-6-12)11(3)14-4/h5-8,10-11H,9H2,1-4H3
InChI Key
CXJYXHFRLZJNKT-UHFFFAOYSA-N
Formula
C13H20O
SMILES
COC(C)c1ccc(CC(C)C)cc1
Molecular Weight1
192.30
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Physical Properties

Property Value Unit Source
ω 0.4861 Relay (1.0) Calculated Property
ΔfH°gas -231.80 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 17.22 kJ/mol Joback Calculated Property
ΔvapH° 64.99 kJ/mol Relay (1.0) Calculated Property
IE 8.59 eV Relay (1.0) Calculated Property
log10WS -3.19 Relay (1.0) Calculated Property
logPoct/wat 3.593 Crippen Calculated Property
McVol 176.140 ml/mol McGowan Calculated Property
Pc 2161.32 kPa Joback Calculated Property
Inp [1322.00; 1322.00]   Show Hide
Inp 1322.00 NIST
Inp 1322.00 NIST
Tboil 502.60 K Relay (1.0) Calculated Property
Tc 709.92 K Relay (1.0) Calculated Property
Tfus 253.07 K Relay (1.0) Calculated Property
Vc 0.648 m3/kmol Relay (1.0) Calculated Property

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Correlations

Property Value Unit Temperature (K) Source
Cp,gas [241.33; 588.02] 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-6.39900e+00
Coefficient B1.04908e+00
Coefficient C-5.42960e-04
Coefficient D8.83000e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 241.33 J/mol×K 273.00 Calculated Property
Cp,gas 300.70 J/mol×K 353.78 Calculated Property
Cp,gas 354.20 J/mol×K 434.56 Calculated Property
Cp,gas 402.12 J/mol×K 515.33 Calculated Property
Cp,gas 444.73 J/mol×K 596.11 Calculated Property
Cp,gas 482.32 J/mol×K 676.89 Calculated Property
Cp,gas 515.17 J/mol×K 757.67 Calculated Property
Cp,gas 543.55 J/mol×K 838.44 Calculated Property
Cp,gas 567.74 J/mol×K 919.22 Calculated Property
Cp,gas 588.02 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0036850; 0.0001555] Pa×s [267.44; 528.30] 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-1.20139e+01
Coefficient B1.71441e+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.267.44
Temperature range, max.528.30
η 0.0036850 Pa×s 267.44 Calculated Property
η 0.0019689 Pa×s 296.42 Calculated Property
η 0.0011762 Pa×s 325.41 Calculated Property
η 0.0007645 Pa×s 354.39 Calculated Property
η 0.0005303 Pa×s 383.38 Calculated Property
η 0.0003873 Pa×s 412.36 Calculated Property
η 0.0002947 Pa×s 441.35 Calculated Property
η 0.0002320 Pa×s 470.33 Calculated Property
η 0.0001877 Pa×s 499.31 Calculated Property
η 0.0001555 Pa×s 528.30 Calculated Property

Similar Compounds

Benzene, 1-(1-hydroxyethyl)-4-isobutyl-. 4-Isobutylbenzoic acid, methyl. 2-[4-(1-Hydroxy-2-methylpropyl)phenyl]propanoic acid, dimethyl. Benzene, (1-methoxyethyl)-. (2R,3S,5S,6R)-2,5-bis(4-Methoxyphenyl)-3,6-dimethyl-1,4-dioxane-rel-. 1,3-dimethyl-isochroman, 1e', 3e. 1,3-dimethyl-isochroman, 1a', 3e. Benzenemethanol, «alpha»-cyclopropyl-4-ethyl-. Ibuprofen, ethyl ester. 4-Butylbenzoic acid, ethyl ester. 1,3-Dioxane, 4-phenyl-. Benzene, 1-(1,1-dimethylethyl)-4-(2-methylpropyl). 4-butylbenzoic acid, pent-2-en-4-ynyl ester. Formic acid, 1-phenylpropyl ester. (1-Propoxyethyl)benzene.

Find more compounds similar to 1-(4-Isobutylphenyl)-1-ethanol, methyl.

Sources

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