Chemical Properties of 1-Benzyl-3-(1,3-dicarbethoxypropyl) urea

1-Benzyl-3-(1,3-dicarbethoxypropyl) urea

InChI
InChI=1S/C17H24N2O5/c1-3-23-15(20)11-10-14(16(21)24-4-2)19-17(22)18-12-13-8-6-5-7-9-13/h5-9,14H,3-4,10-12H2,1-2H3,(H2,18,19,22)
InChI Key
LUKOKKYTVBMHSU-UHFFFAOYSA-N
Formula
C17H24N2O5
SMILES
CCOC(=O)CCC(NC(=O)NCc1ccccc1)C(=O)OCC
Molecular Weight1
336.39
Cheméo is a service of Céondo GmbH, since 2007, we provide simulation, modelling and software development services for the industry. Do not hesitate to contact us for your projects.

Physical Properties

Property Value Unit Source
ΔfusH° 50.84 kJ/mol Joback Calculated Property
ΔvapH° 113.81 kJ/mol Relay (1.0) Calculated Property
log10WS -2.70 Relay (1.0) Calculated Property
logPoct/wat 1.761 Crippen Calculated Property
McVol 263.040 ml/mol McGowan Calculated Property
Tboil 643.48 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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 [821.93; 877.34] J/mol×K [885.45; 1096.12] Show Hide
Cp,gas 821.93 J/mol×K 885.45 Joback Calculated Property
Cp,gas 834.22 J/mol×K 920.56 Joback Calculated Property
Cp,gas 845.24 J/mol×K 955.67 Joback Calculated Property
Cp,gas 855.03 J/mol×K 990.79 Joback Calculated Property
Cp,gas 863.63 J/mol×K 1025.90 Joback Calculated Property
Cp,gas 871.06 J/mol×K 1061.01 Joback Calculated Property
Cp,gas 877.34 J/mol×K 1096.12 Joback Calculated Property

Similar Compounds

1-Benzyl-3-(1-carbethoxy-3-methylbutyl) urea. 1-Benzyl-3-(1,2-dicarbethoxyethyl)urea. mexazolam. Poligodial + Phe (methyl ester) adduct, (S). Poligodial + Phe (methyl ester) adduct, (R). Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 2. 1H-pyrazolo[3,4-d]pyrimidine, 4-(methylthio)-1-beta-d-ribofuranosyl-, 2',3',5'-tribenzoate. 3'-Deoxyguanosine, tris(trimethylsilyl) deriv.. risperidone. 1-Methyl-6«alpha»,7«alpha»-dihydroxyestrone, TMS. Poligodial + o-Tyr (ethyl ester) adduct (R,S), acetylated, # 1. norbormide. 5,6-Dihydrouracil riboside, TMS. Poligodial + m-Tyr (ethyl ester) adduct (R,S). Poligodial + m-Tyr (ethyl ester) adduct (R,S), acetylated, # 1.

Find more compounds similar to 1-Benzyl-3-(1,3-dicarbethoxypropyl) urea.

Sources

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.