- InChI
- InChI=1S/C14H20N2O2/c1-14(2,9-16(3)4)13-15-12(17)10-7-5-6-8-11(10)18-13/h5-8,13H,9H2,1-4H3,(H,15,17)
- InChI Key
- HRIYSWRBGZMFCC-UHFFFAOYSA-N
- Formula
- C14H20N2O2
- SMILES
-
CN(C)CC(C)(C)C1NC(=O)c2ccccc2O
1 - Molecular Weight1
- 248.32
- 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° | 211.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -213.70 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 34.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.04 | kJ/mol | Joback Calculated Property |
| log10WS | -2.86 | Crippen Calculated Property | |
| logPoct/wat | 1.723 | Crippen Calculated Property | |
| McVol | 200.900 | ml/mol | McGowan Calculated Property |
| Pc | 2443.48 | kPa | Joback Calculated Property |
| Tboil | 714.92 | K | Joback Calculated Property |
| Tc | 953.44 | K | Joback Calculated Property |
| Tfus | 535.61 | K | Joback Calculated Property |
| Vc | 0.733 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [588.49; 678.20] | J/mol×K | [714.92; 953.44] | 
|
| Cp,gas | 588.49 | J/mol×K | 714.92 | Joback Calculated Property |
| Cp,gas | 606.64 | J/mol×K | 754.67 | Joback Calculated Property |
| Cp,gas | 623.43 | J/mol×K | 794.43 | Joback Calculated Property |
| Cp,gas | 638.91 | J/mol×K | 834.18 | Joback Calculated Property |
| Cp,gas | 653.15 | J/mol×K | 873.94 | Joback Calculated Property |
| Cp,gas | 666.23 | J/mol×K | 913.69 | Joback Calculated Property |
| Cp,gas | 678.20 | J/mol×K | 953.44 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Benzoxazone, 2-(2'-dimethylamino-1',1'-dimethylethyl)-.
Sources
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