Chemical Properties of Sarcosine, N-(4-methylbenzoyl)-, hexyl ester

Sarcosine, N-(4-methylbenzoyl)-, hexyl ester

InChI
InChI=1S/C17H25NO3/c1-4-5-6-7-12-21-16(19)13-18(3)17(20)15-10-8-14(2)9-11-15/h8-11H,4-7,12-13H2,1-3H3
InChI Key
ZEONWHNNKRAGED-UHFFFAOYSA-N
Formula
C17H25NO3
SMILES
CCCCCCOC(=O)CN(C)C(=O)c1ccc(C)cc1
Molecular Weight1
291.39
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Physical Properties

Property Value Unit Source
ΔfusH° 42.43 kJ/mol Joback Calculated Property
ΔvapH° 94.64 kJ/mol Relay (1.0) Calculated Property
IE 8.34 eV Relay (1.0) Calculated Property
log10WS -3.89 Relay (1.0) Calculated Property
logPoct/wat 3.191 Crippen Calculated Property
McVol 245.620 ml/mol McGowan Calculated Property
Pc 1641.76 kPa Joback Calculated Property
Inp 2316.00 NIST
Tboil 630.72 K Relay (1.0) Calculated Property
Tfus 296.58 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, 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 [344.18; 809.97] 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-1.00940e+01
Coefficient B1.52156e+00
Coefficient C-8.64460e-04
Coefficient D1.62960e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 344.18 J/mol×K 273.00 Calculated Property
Cp,gas 427.22 J/mol×K 353.78 Calculated Property
Cp,gas 501.24 J/mol×K 434.56 Calculated Property
Cp,gas 566.75 J/mol×K 515.33 Calculated Property
Cp,gas 624.26 J/mol×K 596.11 Calculated Property
Cp,gas 674.30 J/mol×K 676.89 Calculated Property
Cp,gas 717.37 J/mol×K 757.67 Calculated Property
Cp,gas 754.00 J/mol×K 838.44 Calculated Property
Cp,gas 784.69 J/mol×K 919.22 Calculated Property
Cp,gas 809.97 J/mol×K 1000.00 Calculated Property

Similar Compounds

Sarcosine, N-(4-methylbenzoyl)-, heptyl ester. Sarcosine, N-(4-methylbenzoyl)-, decyl ester. Sarcosine, N-(4-methylbenzoyl)-, octyl ester. Sarcosine, N-(4-methylbenzoyl)-, pentadecyl ester. Sarcosine, N-(4-methylbenzoyl)-, tetradecyl ester. Sarcosine, N-(4-methylbenzoyl)-, undecyl ester. Sarcosine, N-(4-methylbenzoyl)-, nonyl ester. Sarcosine, N-(4-methylbenzoyl)-, dodecyl ester. Sarcosine, N-(4-methylbenzoyl)-, pentyl ester. Sarcosine, n-(4-methylbenzoyl)-, isohexyl ester. Sarcosine, N-(4-methylbenzoyl)-, butyl ester. Sarcosine, N-(4-ethylbenzoyl)-, hexyl ester. Sarcosine, N-(4-ethylbenzoyl)-, heptyl ester. Sarcosine, N-(4-ethylbenzoyl)-, tetradecyl ester. Sarcosine, N-(4-ethylbenzoyl)-, decyl ester.

Find more compounds similar to Sarcosine, N-(4-methylbenzoyl)-, hexyl ester.

Sources

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