- InChI
- InChI=1S/C25H19NO2/c27-25(26(22-12-6-2-7-13-22)23-14-8-3-9-15-23)28-24-18-16-21(17-19-24)20-10-4-1-5-11-20/h1-19H
- InChI Key
- AEYFPYAZOWKZRY-UHFFFAOYSA-N
- Formula
- C25H19NO2
- SMILES
-
O=C(Oc1ccc(-c2ccccc2)cc1)N(c1c
cccc1)c1ccccc1 - Molecular Weight1
- 365.42
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 476.49 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 198.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.21 | kJ/mol | Joback Calculated Property |
| log10WS | -7.88 | Crippen Calculated Property | |
| logPoct/wat | 6.691 | Crippen Calculated Property | |
| McVol | 285.490 | ml/mol | McGowan Calculated Property |
| Pc | 1949.23 | kPa | Joback Calculated Property |
| Inp | [3305.00; 3305.00] |
|
|
| Inp | 3305.00 | NIST | |
| Inp | 3305.00 | NIST | |
| Tboil | 971.83 | K | Joback Calculated Property |
| Tc | 1240.95 | K | Joback Calculated Property |
| Tfus | 594.34 | K | Joback Calculated Property |
| Vc | 1.046 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [868.94; 931.71] | J/mol×K | [971.83; 1240.95] |
|
| Cp,gas | 868.94 | J/mol×K | 971.83 | Joback Calculated Property |
| Cp,gas | 882.31 | J/mol×K | 1016.68 | Joback Calculated Property |
| Cp,gas | 894.27 | J/mol×K | 1061.54 | Joback Calculated Property |
| Cp,gas | 905.01 | J/mol×K | 1106.39 | Joback Calculated Property |
| Cp,gas | 914.70 | J/mol×K | 1151.24 | Joback Calculated Property |
| Cp,gas | 923.54 | J/mol×K | 1196.10 | Joback Calculated Property |
| Cp,gas | 931.71 | J/mol×K | 1240.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N,N-Diphenylcarbamic acid, 4-biphenyl ester.
Sources
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