Chemical Properties of Phenoxyacetamide (CAS 621-88-5)

Phenoxyacetamide

InChI
InChI=1S/C8H9NO2/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,10)
InChI Key
AOPRXJXHLWYPQR-UHFFFAOYSA-N
Formula
C8H9NO2
SMILES
NC(=O)COc1ccccc1
Molecular Weight1
151.16
CAS
621-88-5
Other Names
  • 2-Phenoxyacetamide
  • Acetamide, 2-phenoxy-
  • Alpha-phenoxyacetamide
  • Phenoxyacetic amide
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Physical Properties

Property Value Unit Source
ω 0.6171 Relay (1.0) Calculated Property
ΔfH°gas -265.35 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 18.50 kJ/mol Joback Calculated Property
ΔvapH° 67.63 kJ/mol Relay (1.0) Calculated Property
IE 8.75 eV Relay (1.0) Calculated Property
log10WS -1.27 Relay (1.0) Calculated Property
logPoct/wat 0.551 Crippen Calculated Property
McVol 117.240 ml/mol McGowan Calculated Property
Pc 4151.61 kPa Joback Calculated Property
Tboil 533.82 K Relay (1.0) Calculated Property
Tc 773.70 K Relay (1.0) Calculated Property
Tfus 375.15 K Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation 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 [154.64; 357.02] 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 A1.06100e+00
Coefficient B6.55600e-01
Coefficient C-3.56300e-04
Coefficient D5.66600e-08
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 154.64 J/mol×K 273.00 Calculated Property
Cp,gas 190.91 J/mol×K 353.78 Calculated Property
Cp,gas 223.32 J/mol×K 434.56 Calculated Property
Cp,gas 252.05 J/mol×K 515.33 Calculated Property
Cp,gas 277.26 J/mol×K 596.11 Calculated Property
Cp,gas 299.15 J/mol×K 676.89 Calculated Property
Cp,gas 317.89 J/mol×K 757.67 Calculated Property
Cp,gas 333.67 J/mol×K 838.44 Calculated Property
Cp,gas 346.65 J/mol×K 919.22 Calculated Property
Cp,gas 357.02 J/mol×K 1000.00 Calculated Property

Similar Compounds

Ethanamine, 2-phenoxy-. Acetyl chloride, phenoxy-. 2-Propanone, 1-phenoxy-. 2-(3-Chlorophenoxy)thioacetamide. Acetic acid, phenoxy-. 2-(4-Chlorophenoxy)thioacetamide. (2-Propynyloxy)benzene. 2-(2-Chlorophenoxy)thioacetamide. Acetic acid, phenoxy-, methyl ester. Benzene, ethoxy-. 1-Methyl-2-phenoxyethylamine. 3-Methoxyphenoxyacetic acid. Benzene, (2-chloroethoxy)-. 3-Chlorophenoxyacetonitrile. Benzene, 1,1'-[1,2-ethanediylbis(oxy)]bis-.

Find more compounds similar to Phenoxyacetamide.

Sources

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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
Compiled This icon marks a compiled value or equation: taken from a data compilation such as ChemSep, not from an original measurement report.
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