- InChI
- InChI=1S/C16H16N2O3/c1-17(2)16(19)15(12-6-4-3-5-7-12)13-8-10-14(11-9-13)18(20)21/h3-11,15H,1-2H3
- InChI Key
- CPJQCZRPEWVBCC-UHFFFAOYSA-N
- Formula
- C16H16N2O3
- SMILES
-
CN(C)C(=O)C(c1ccccc1)c1ccc([N+
](=O)[O-])cc1 - Molecular Weight1
- 284.31
- 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° | 314.00 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 26.93 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.35 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.42 | kJ/mol | Joback Calculated Property |
| log10WS | -3.79 | Crippen Calculated Property | |
| logPoct/wat | 2.815 | Crippen Calculated Property | |
| McVol | 217.750 | ml/mol | McGowan Calculated Property |
| Pc | 2436.25 | kPa | Joback Calculated Property |
| Inp | [2446.00; 2449.00] |
|
|
| Inp | 2449.00 | NIST | |
| Inp | 2446.00 | NIST | |
| Inp | 2446.00 | NIST | |
| Inp | 2449.00 | NIST | |
| Tboil | 841.53 | K | Joback Calculated Property |
| Tc | 1096.81 | K | Joback Calculated Property |
| Tfus | 546.45 | K | Joback Calculated Property |
| Vc | 0.816 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [634.30; 698.74] | J/mol×K | [841.53; 1096.81] |
|
| Cp,gas | 634.30 | J/mol×K | 841.53 | Joback Calculated Property |
| Cp,gas | 647.79 | J/mol×K | 884.08 | Joback Calculated Property |
| Cp,gas | 660.02 | J/mol×K | 926.62 | Joback Calculated Property |
| Cp,gas | 671.11 | J/mol×K | 969.17 | Joback Calculated Property |
| Cp,gas | 681.19 | J/mol×K | 1011.71 | Joback Calculated Property |
| Cp,gas | 690.36 | J/mol×K | 1054.26 | Joback Calculated Property |
| Cp,gas | 698.74 | J/mol×K | 1096.81 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to N,N-Dimethyl-2-(4-nitro-phenyl)-2-phenyl-acetamide.
Sources
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