- InChI
- InChI=1S/C17H20N2O4/c1-18-13-8-6-5-7-12(13)17(20)19-11-9-14(21-2)16(23-4)15(10-11)22-3/h5-10,18H,1-4H3,(H,19,20)
- InChI Key
- BJIUTMDVMUBADL-UHFFFAOYSA-N
- Formula
- C17H20N2O4
- SMILES
-
CNc1ccccc1C(=O)Nc1cc(OC)c(OC)c
(OC)c1 - Molecular Weight1
- 316.35
- CAS
- 1043-91-0
- 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).
- 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° | 13.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -369.33 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.48 | kJ/mol | Joback Calculated Property |
| log10WS | -3.82 | Crippen Calculated Property | |
| logPoct/wat | 3.006 | Crippen Calculated Property | |
| McVol | 242.010 | ml/mol | McGowan Calculated Property |
| Pc | 2047.46 | kPa | Joback Calculated Property |
| Tboil | 883.11 | K | Joback Calculated Property |
| Tc | 1109.22 | K | Joback Calculated Property |
| Tfus | 606.21 | K | Joback Calculated Property |
| Vc | 0.901 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [730.22; 786.76] | J/mol×K | [883.11; 1109.22] | 
|
| Cp,gas | 730.22 | J/mol×K | 883.11 | Joback Calculated Property |
| Cp,gas | 742.98 | J/mol×K | 920.79 | Joback Calculated Property |
| Cp,gas | 754.41 | J/mol×K | 958.48 | Joback Calculated Property |
| Cp,gas | 764.51 | J/mol×K | 996.16 | Joback Calculated Property |
| Cp,gas | 773.27 | J/mol×K | 1033.85 | Joback Calculated Property |
| Cp,gas | 780.69 | J/mol×K | 1071.53 | Joback Calculated Property |
| Cp,gas | 786.76 | J/mol×K | 1109.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Benzanilide,3',4',5'-trimethoxy-2-methylamino-.
Sources
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