Chemical Properties of Acetamide, N-[1-(3-acetoxyphenyl)-2-propyl]-

Acetamide, N-[1-(3-acetoxyphenyl)-2-propyl]-

InChI
InChI=1S/C13H17NO3/c1-9(14-10(2)15)7-12-5-4-6-13(8-12)17-11(3)16/h4-6,8-9H,7H2,1-3H3,(H,14,15)
InChI Key
XDNDXWPJPHJZHB-UHFFFAOYSA-N
Formula
C13H17NO3
SMILES
CC(=O)NC(C)Cc1cccc(OC(C)=O)c1
Molecular Weight1
235.28
Other Names
  • Fenproporex-M (N-desalkyl-3-HO-), 2AC
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Physical Properties

Property Value Unit Source
ΔfH°gas -550.23 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 30.62 kJ/mol Joback Calculated Property
ΔvapH° 91.38 kJ/mol Relay (1.0) Calculated Property
IE 8.34 eV Relay (1.0) Calculated Property
log10WS -2.10 Relay (1.0) Calculated Property
logPoct/wat 1.679 Crippen Calculated Property
McVol 189.260 ml/mol McGowan Calculated Property
Inp 1930.00 NIST
Tboil 586.39 K Relay (1.0) Calculated Property
Tfus 328.38 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [510.26; 581.26] J/mol×K [690.52; 902.80] Show Hide
Cp,gas 510.26 J/mol×K 690.52 Joback Calculated Property
Cp,gas 524.49 J/mol×K 725.90 Joback Calculated Property
Cp,gas 537.72 J/mol×K 761.28 Joback Calculated Property
Cp,gas 550.00 J/mol×K 796.66 Joback Calculated Property
Cp,gas 561.33 J/mol×K 832.04 Joback Calculated Property
Cp,gas 571.74 J/mol×K 867.42 Joback Calculated Property
Cp,gas 581.26 J/mol×K 902.80 Joback Calculated Property

Similar Compounds

R,S-N-methyl-1-(2-methoxyphenyl)-2-aminopropane-M (bis-desmethyl-methoxy-), 2AC. Acetamide, n-(p-hydroxy-alpha-methylphenethyl)-, acetate. Acetamide, N-(p-hydroxy-«alpha»-methylphenethyl)-, acetate (ester). Methylenedioxyamphetamine acetate. Fenproporex-M (N-desalkyl-HO-methoxy-), 2AC. 3-Methoxymethamphetamine. Methylenedioxyamphetamine, N,-heptafluorobutyryl deriv.. (.+/-.)-MDEA. l-Tyrosine, N,O-bis(butyryl)-, methyl ester. N-methyl-3,4-methylenedioxyamphetamine. R,S-N-methyl-1-(2-methoxyphenyl)-2-aminopropane-M (O-demethyl-HO-aryl-), 3AC. 1,2-Benzenediol, 4-[2-[[2-(1,3-benzodioxol-5-yl)-1-methylethyl]amino]-1-hydroxyethyl]-. Tyrosine, N-TFA-O-TMS. tyrosine, trifluoroacetyl-isopropyl ester. N-Methyl-1-(1,3-benzodioxol-5-yl)-2-butanamine.

Find more compounds similar to Acetamide, N-[1-(3-acetoxyphenyl)-2-propyl]-.

Sources

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