Chemical Properties of Aniline, 2-tert-butyl-n-ethyl- (CAS 75031-45-7)

Aniline, 2-tert-butyl-n-ethyl-

InChI
InChI=1S/C12H19N/c1-5-13-11-9-7-6-8-10(11)12(2,3)4/h6-9,13H,5H2,1-4H3
InChI Key
FFEJLRPCIUMIBB-UHFFFAOYSA-N
Formula
C12H19N
SMILES
CCNc1ccccc1C(C)(C)C
Molecular Weight1
177.29
CAS
75031-45-7
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Physical Properties

Property Value Unit Source
ΔfH°gas -52.20 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 18.17 kJ/mol Joback Calculated Property
ΔvapH° 65.39 kJ/mol Relay (1.0) Calculated Property
IE 7.45 eV Relay (1.0) Calculated Property
log10WS -3.75 Relay (1.0) Calculated Property
logPoct/wat 3.416 Crippen Calculated Property
McVol 166.160 ml/mol McGowan Calculated Property
Tboil 518.45 K Relay (1.0) Calculated Property
Tc 742.06 K Relay (1.0) Calculated Property
Tfus 240.52 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor 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 [220.07; 555.21] 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-5.33090e+01
Coefficient B1.20748e+00
Coefficient C-8.13560e-04
Coefficient D2.14600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 220.07 J/mol×K 273.00 Calculated Property
Cp,gas 281.55 J/mol×K 353.78 Calculated Property
Cp,gas 335.39 J/mol×K 434.56 Calculated Property
Cp,gas 382.26 J/mol×K 515.33 Calculated Property
Cp,gas 422.84 J/mol×K 596.11 Calculated Property
Cp,gas 457.82 J/mol×K 676.89 Calculated Property
Cp,gas 487.87 J/mol×K 757.67 Calculated Property
Cp,gas 513.66 J/mol×K 838.44 Calculated Property
Cp,gas 535.88 J/mol×K 919.22 Calculated Property
Cp,gas 555.21 J/mol×K 1000.00 Calculated Property

Similar Compounds

Aniline, n-allyl-o-tert-butyl-. Aniline, 2-tert-butyl-n-beta-cyanoethyl-. Aniline, n-isobutyl-2-tert-butyl-. Aniline, o-tert-butyl-n-methyl-. Acetanilide, 2-tert-butyl-. Glycinic acid, n-2-tert-butyl-phenyl-, ethyl ester. Aniline, 2-tert-butyl-n-sec-butyl-. Propane, 1,3-bis(2-tert-butyl-4-methyl-anilino)-. Aniline, 2,4,-di-tert-butyl-n-methyl-. Aniline, 2-methyl-4-tert-butyl-n-ethyl-. P-phenylenediamine, 2-tert-butyl-n-methyl. Acetamide, N-[2,4-bis(1,1-dimethylethyl)phenyl]-. Aniline, 2-tert-butyl-n-cyclohexyl-. Oxanilic acid, 2-tert-butyl-, ethyl ester. Acetanilide, 2-tert-butyl-5-methyl.

Find more compounds similar to Aniline, 2-tert-butyl-n-ethyl-.

Sources

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