- InChI
- InChI=1S/C8H15NO2/c1-4-9(5-2)8(11)6-7(3)10/h4-6H2,1-3H3
- InChI Key
- NTMXFHGYWJIAAE-UHFFFAOYSA-N
- Formula
- C8H15NO2
- SMILES
- CCN(CC)C(=O)CC(C)=O
- Molecular Weight1
- 157.21
- CAS
- 2235-46-3
- Other Names
-
- Acetoacetamide, N,N-diethyl-
- Diethylacetoacetamide
- N,N-Diethylacetoacetamide
- 1-(Diethylcarbamoyl)-2-propanone
- Acetoacetdiethylamide
- Diethylamid kyseliny acetoctove
- N,N-diethyl-3-oxobutyramide
- 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° | -130.58 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -366.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 22.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.94 | kJ/mol | Joback Calculated Property |
| log10WS | -0.80 | Crippen Calculated Property | |
| logPoct/wat | 0.834 | Crippen Calculated Property | |
| McVol | 136.700 | ml/mol | McGowan Calculated Property |
| Pc | 2884.30 | kPa | Joback Calculated Property |
| Tboil | 502.62 | K | Joback Calculated Property |
| Tc | 686.30 | K | Joback Calculated Property |
| Tfus | 312.25 | K | Joback Calculated Property |
| Vc | 0.513 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [307.89; 374.69] | J/mol×K | [502.62; 686.30] | 
|
| Cp,gas | 307.89 | J/mol×K | 502.62 | Joback Calculated Property |
| Cp,gas | 320.47 | J/mol×K | 533.23 | Joback Calculated Property |
| Cp,gas | 332.45 | J/mol×K | 563.85 | Joback Calculated Property |
| Cp,gas | 343.84 | J/mol×K | 594.46 | Joback Calculated Property |
| Cp,gas | 354.67 | J/mol×K | 625.08 | Joback Calculated Property |
| Cp,gas | 364.94 | J/mol×K | 655.69 | Joback Calculated Property |
| Cp,gas | 374.69 | J/mol×K | 686.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Butanamide, N,N-diethyl-3-oxo-.
Sources
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