Chemical Properties of Propanamide, N-(4-bromophenyl)-3-phenyl-

Propanamide, N-(4-bromophenyl)-3-phenyl-

InChI
InChI=1S/C15H14BrNO/c16-13-7-9-14(10-8-13)17-15(18)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2,(H,17,18)
InChI Key
HGPWLPIFXDCULJ-UHFFFAOYSA-N
Formula
C15H14BrNO
SMILES
O=C(CCc1ccccc1)Nc1ccc(Br)cc1
Molecular Weight1
304.18
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° 34.28 kJ/mol Joback Calculated Property
IE 8.22 eV Relay (1.0) Calculated Property
log10WS -4.47 Relay (1.0) Calculated Property
logPoct/wat 4.020 Crippen Calculated Property
McVol 203.740 ml/mol McGowan Calculated Property
Pc 2871.95 kPa Joback Calculated Property
Inp [2423.00; 2423.00]   Show Hide
Inp 2423.00 NIST
Inp 2423.00 NIST
Tboil 645.39 K Relay (1.0) Calculated Property
Tfus 387.33 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization 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 [242.82; 588.08] 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-4.99180e+01
Coefficient B1.29790e+00
Coefficient C-8.88860e-04
Coefficient D2.28960e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 242.82 J/mol×K 273.00 Calculated Property
Cp,gas 308.14 J/mol×K 353.78 Calculated Property
Cp,gas 365.03 J/mol×K 434.56 Calculated Property
Cp,gas 414.21 J/mol×K 515.33 Calculated Property
Cp,gas 456.42 J/mol×K 596.11 Calculated Property
Cp,gas 492.37 J/mol×K 676.89 Calculated Property
Cp,gas 522.78 J/mol×K 757.67 Calculated Property
Cp,gas 548.39 J/mol×K 838.44 Calculated Property
Cp,gas 569.92 J/mol×K 919.22 Calculated Property
Cp,gas 588.08 J/mol×K 1000.00 Calculated Property

Similar Compounds

Propanamide, N-(4-fluorophenyl)-3-phenyl-. Propanamide, N-(3-methoxyphenyl)-3-phenyl-. Propanamide, N-(3-nitrophenyl)-3-phenyl-. Propanamide, N-(2-iodo-4-methylphenyl)-3-phenyl-. Propanamide, N-(2,5-dimethoxyphenyl)-3-phenyl-. Glutaric acid, monoamide, N-(4-ethylphenyl)-, ethyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, hexyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, octyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, undecyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, heptyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, nonyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, dodecyl ester. Glutaric acid, monoamide, N-(4-ethylphenyl)-, decyl ester. Glutaric acid, diamide, N,N'-di(2-ethylphenyl)-. Glutaric acid, monoamide, N-(4-ethylphenyl)-, pentyl ester.

Find more compounds similar to Propanamide, N-(4-bromophenyl)-3-phenyl-.

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.